4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide

C17H17N3O2 — CID 109201823

IUPAC4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(Nc2ccnc(C(=O)NC3CC3)c2)cc1
InChIInChI=1S/C17H17N3O2/c1-11(21)12-2-4-13(5-3-12)19-15-8-9-18-16(10-15)17(22)20-14-6-7-14/h2-5,8-10,14H,6-7H2,1H3,(H,18,19)(H,20,22)
InChIKeyNLSAZMJBFKMXAV-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.92
Rot. Bonds5

About 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide

4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide (PubChem CID 109201823) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide
PubChem CID109201823
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(Nc2ccnc(C(=O)NC3CC3)c2)cc1
InChIInChI=1S/C17H17N3O2/c1-11(21)12-2-4-13(5-3-12)19-15-8-9-18-16(10-15)17(22)20-14-6-7-14/h2-5,8-10,14H,6-7H2,1H3,(H,18,19)(H,20,22)
InChIKeyNLSAZMJBFKMXAV-UHFFFAOYSA-N
XLogP2.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-acetylanilino)-N-(4-acetylphenyl)pyridine-2-carboxamide
CID 109222150
N-cyclopropyl-4-[4-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109201821
4-(4-chloroanilino)-N-cyclopentylpyridine-2-carboxamide
CID 109204096
4-(4-acetylanilino)-N-tert-butylpyridine-2-carboxamide
CID 109216893
4-(3-bromoanilino)-N-cyclopropylpyridine-2-carboxamide
CID 109201843
4-(3-acetamidoanilino)-N-cycloheptylpyridine-2-carboxamide
CID 109217101
N-cycloheptyl-4-(4-propan-2-yloxyanilino)pyridine-2-carboxamide
CID 109217095
N-cyclohexyl-4-[4-(diethylamino)anilino]pyridine-2-carboxamide
CID 109204867
4-(methylamino)-N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 55042259
N-cyclopentyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
CID 109204088
N-cyclopentyl-4-(2-methylanilino)pyridine-2-carboxamide
CID 109204070
ethyl 4-[[4-(4-ethylanilino)pyridine-2-carbonyl]amino]piperidine-1-carboxylate
CID 109215853

Frequently Asked Questions

What is the IUPAC name of 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide?
The IUPAC name of 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide (CID 109201823) is 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide.
What is the SMILES notation for 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide?
The canonical SMILES for 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide is CC(=O)c1ccc(Nc2ccnc(C(=O)NC3CC3)c2)cc1.
What is the InChIKey of 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide?
The InChIKey is NLSAZMJBFKMXAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-11(21)12-2-4-13(5-3-12)19-15-8-9-18-16(10-15)17(22)20-14-6-7-14/h2-5,8-10,14H,6-7H2,1H3,(H,18,19)(H,20,22).
What are the key properties of 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide?
4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-acetylanilino)-N-cyclopropylpyridine-2-carboxamide is sourced from PubChem (CID 109201823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).