2-Butyn-1-amine, N-methyl-4-(1-pyrrolidinyl)-
Basic information
- CAS
75858-55-8- Standard SMILES
CNCC#CCN1CCCC1- InChIKey
MHUJGFJOUGZSSK-UHFFFAOYSA-N- Molecular formula
- C9H16N2
- Average molar mass
- 152.24 g/mol
- Monoisotopic mass
- 152.13134852
Names & identifiers
- Preferred name
- 2-Butyn-1-amine, N-methyl-4-(1-pyrrolidinyl)-
- IUPAC
- N-methyl-4-pyrrolidin-1-ylbut-2-yn-1-amine
Names & synonyms
75858-55-82-Butyn-1-amine, N-methyl-4-(1-pyrrolidinyl)-DTXSID00336735RefChem:258104DTXCID90287823N-methyl-4-(1-pyrrolidinyl)-2-butynamineSCHEMBL9452394AKOS040806454N-Methyl-4-(pyrrolidin-1-yl)but-2-yn-1-amineMethylamine, N-[4-(1-pyrrolidinyl)-2-butynyl]-N-Methyl-4-(1-pyrrolidinyl)-2-butyn-1-amine #METHYL[4-(PYRROLIDIN-1-YL)BUT-2-YN-1-YL]AMINE
Database identifiers
- CAS
75858-55-8- PubChem CID
- 535893
- DTXSID
DTXSID00336735
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 157
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Related reactions
1 records
Compound notes
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