2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide

C10H11ClN2O — CID 62225149

IUPAC2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide
SMILESO=C(NC1CC1)C(Cl)c1cccnc1
InChIInChI=1S/C10H11ClN2O/c11-9(7-2-1-5-12-6-7)10(14)13-8-3-4-8/h1-2,5-6,8-9H,3-4H2,(H,13,14)
InChIKeyNXYUPXNESYHUSW-UHFFFAOYSA-N
MW210.66 g/mol
LogP1.64
Rot. Bonds3

About 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide

2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide (PubChem CID 62225149) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide
PubChem CID62225149
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide
SMILESO=C(NC1CC1)C(Cl)c1cccnc1
InChIInChI=1S/C10H11ClN2O/c11-9(7-2-1-5-12-6-7)10(14)13-8-3-4-8/h1-2,5-6,8-9H,3-4H2,(H,13,14)
InChIKeyNXYUPXNESYHUSW-UHFFFAOYSA-N
XLogP1.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-propan-2-yl-2-pyridin-3-ylacetamide
CID 62225327
N-(4-aminocyclohexyl)-2-pyridin-3-ylpropanamide
CID 119475339
3-amino-N-cyclopropyl-3-pyridin-3-ylpropanamide
CID 82077122
3-(cyclohexylamino)-3-oxo-2-pyridin-3-ylpropanoic acid
CID 91593351
(2R)-2-(cyclopropylamino)-2-pyridin-3-ylacetic acid
CID 93280695
N-(4-aminocyclohexyl)-2-chloro-2-phenylacetamide
CID 62318890
2-chloro-N-cyclopentyl-2-(6-methyl-3-pyridinyl)acetamide
CID 104823455
2-chloro-N-cyclohexyl-2-phenylacetamide
CID 11032339
2-chloro-N-cyclopropyl-2-(3-fluorophenyl)acetamide
CID 62225506
N-cyclopropyl-2-[[(1R)-1-pyridin-3-ylethyl]amino]acetamide
CID 81404358
2-chloro-N-cyclopropyl-2-[4-(difluoromethyl)phenyl]acetamide
CID 115525365
2-chloro-N-[(1R)-1-pyridin-3-ylethyl]propanamide
CID 81405185

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide?
The IUPAC name of 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide (CID 62225149) is 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide.
What is the SMILES notation for 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide?
The canonical SMILES for 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide is O=C(NC1CC1)C(Cl)c1cccnc1.
What is the InChIKey of 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide?
The InChIKey is NXYUPXNESYHUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c11-9(7-2-1-5-12-6-7)10(14)13-8-3-4-8/h1-2,5-6,8-9H,3-4H2,(H,13,14).
What are the key properties of 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide?
2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide has a molecular weight of 210.66 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclopropyl-2-pyridin-3-ylacetamide is sourced from PubChem (CID 62225149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).