3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide

C10H13ClN4O — CID 116795102

IUPAC3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2ccnc(Cl)n2)C1
InChIInChI=1S/C10H13ClN4O/c11-10-13-4-3-8(15-10)14-9(16)6-1-2-7(12)5-6/h3-4,6-7H,1-2,5,12H2,(H,13,14,15,16)
InChIKeyRBEIIQGZQLHSQD-UHFFFAOYSA-N
MW240.69 g/mol
LogP1.20
Rot. Bonds2

About 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide

3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide (PubChem CID 116795102) has the molecular formula C10H13ClN4O and a molecular weight of 240.69 g/mol. Its IUPAC name is 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide
PubChem CID116795102
Molecular FormulaC10H13ClN4O
Molecular Weight240.69 g/mol
Exact Mass240.08
IUPAC Name3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)Nc2ccnc(Cl)n2)C1
InChIInChI=1S/C10H13ClN4O/c11-10-13-4-3-8(15-10)14-9(16)6-1-2-7(12)5-6/h3-4,6-7H,1-2,5,12H2,(H,13,14,15,16)
InChIKeyRBEIIQGZQLHSQD-UHFFFAOYSA-N
XLogP1.20
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chloropyrimidin-4-yl)-4-methylcyclohexane-1-carboxamide
CID 116798469
3-amino-N-(4-chlorophenyl)cyclopentane-1-carboxamide
CID 66031270
N-(2-chloropyrimidin-4-yl)-2-cyclohexylacetamide
CID 116798496
N-(2-chloropyrimidin-4-yl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 116798426
N-(2-chloropyrimidin-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102780141
3-amino-N-(4-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670946
3-amino-N-(2-propan-2-ylpyrazol-3-yl)cyclopentane-1-carboxamide
CID 66031864
3-amino-N-quinoxalin-6-ylcyclopentane-1-carboxamide;hydrochloride
CID 119708395
2-chloro-N-(2-chloropyrimidin-4-yl)acetamide
CID 116794848
3-amino-N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexane-1-carboxamide
CID 119700137
3-amino-N-quinolin-6-ylcyclopentane-1-carboxamide;dihydrochloride
CID 119842997
cis-(1R,3S)-3-amino-N-(6-chloropyrimidin-4-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 154700196

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide (CID 116795102) is 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide is NC1CCC(C(=O)Nc2ccnc(Cl)n2)C1.
What is the InChIKey of 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide?
The InChIKey is RBEIIQGZQLHSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN4O/c11-10-13-4-3-8(15-10)14-9(16)6-1-2-7(12)5-6/h3-4,6-7H,1-2,5,12H2,(H,13,14,15,16).
What are the key properties of 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide?
3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide has a molecular weight of 240.69 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-chloropyrimidin-4-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 116795102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).