N'-(1-Cyclohexylpyrrolidin-3-yl)-N-(4-methoxyphenyl)carbamimidic acid
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Basic information
- CAS
19985-19-4- Standard SMILES
COc1ccc(NC(=O)NC2CCN(C3CCCCC3)C2)cc1- InChIKey
FEFSEIPHMDRMSW-UHFFFAOYSA-N- Molecular formula
- C18H27N3O2
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.21032711
Names & identifiers
- Preferred name
- N'-(1-Cyclohexylpyrrolidin-3-yl)-N-(4-methoxyphenyl)carbamimidic acid
- IUPAC
- 1-(1-cyclohexylpyrrolidin-3-yl)-3-(4-methoxyphenyl)urea
- English name
- 1-(1-Cyclohexyl-3-pyrrolidinyl)-3-(p-methoxyphenyl)urea
- Molecular formula
- C18H27N3O2
- Molecular weight
- 317.43
Names & synonyms
19985-19-4DTXSID00941924N'-(1-Cyclohexylpyrrolidin-3-yl)-N-(4-methoxyphenyl)carbamimidic acidRefChem:1090119DTXCID9013703461-(1-Cyclohexyl-3-pyrrolidinyl)-3-(p-methoxyphenyl)urea1-(1-cyclohexylpyrrolidin-3-yl)-3-(4-methoxyphenyl)ureaBRN 0489195Urea, 1-(1-cyclohexyl-3-pyrrolidinyl)-3-(p-methoxyphenyl)-Urea, N-(1-cyclohexyl-3-pyrrolidinyl)-N'-(4-methoxyphenyl)-
Database identifiers
- CAS
19985-19-4- PubChem CID
- 209544
- DTXSID
DTXSID00941924- Nikkaji
- J87.627E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
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Compound notes
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