{1-[1-(5-Iodo-pyrimidin-2-yl)-cyclopropylcarbamoyl]-cyclopropyl}-carbamic acid tert-butyl ester

HCID 67508490
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NC1(C(=O)NC2(c3ncc(I)cn3)CC2)CC1
InChIKey
OFSUVYHOFILQJB-UHFFFAOYSA-N
Molecular formula
C16H21IN4O3
Average molar mass
444.27 g/mol

Names & identifiers

Preferred name
{1-[1-(5-Iodo-pyrimidin-2-yl)-cyclopropylcarbamoyl]-cyclopropyl}-carbamic acid tert-butyl ester
IUPAC
tert-butyl N-[1-[[1-(5-iodopyrimidin-2-yl)cyclopropyl]carbamoyl]cyclopropyl]carbamate

Names & synonyms

SCHEMBL2713207OFSUVYHOFILQJB-UHFFFAOYSA-N{1-[1-(5-iodo-pyrimidin-2-yl)-cyclopropylcarbamoyl]-cyclopropyl}-carbamic acid tert-butyl ester

Database identifiers

PubChem CID
67508490

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
93.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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