N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide

C18H21N3O2 — CID 109182280

IUPACN-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-16-9-6-14(7-10-16)20-15-8-11-17(19-12-15)18(22)21-13-4-2-3-5-13/h6-13,20H,2-5H2,1H3,(H,21,22)
InChIKeyMREGWWGCSNGSGO-UHFFFAOYSA-N
MW311.39 g/mol
LogP3.51
Rot. Bonds5

About N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide

N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide (PubChem CID 109182280) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide
PubChem CID109182280
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC NameN-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-16-9-6-14(7-10-16)20-15-8-11-17(19-12-15)18(22)21-13-4-2-3-5-13/h6-13,20H,2-5H2,1H3,(H,21,22)
InChIKeyMREGWWGCSNGSGO-UHFFFAOYSA-N
XLogP3.51
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109182282
N-cyclohexyl-5-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109183016
N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
CID 109195297
5-(4-acetamidoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183029
N-cyclopropyl-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109179866
5-(4-cyanoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183058
N-cyclopropyl-5-[4-(dimethylamino)anilino]pyridine-2-carboxamide
CID 109179984
N-tert-butyl-5-(4-methoxyanilino)pyridine-2-carboxamide
CID 109195102
N-cyclopropyl-5-(3,5-dimethylanilino)pyridine-2-carboxamide
CID 109179932
1-cyclopropyl-3-[5-(4-methoxyanilino)-2-pyridinyl]urea
CID 113034207
N-cyclopentyl-5-(2-methylanilino)pyridine-2-carboxamide
CID 109182241
N-(4-methoxyphenyl)-5-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109199887

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide (CID 109182280) is N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide is COc1ccc(Nc2ccc(C(=O)NC3CCCC3)nc2)cc1.
What is the InChIKey of N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide?
The InChIKey is MREGWWGCSNGSGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-23-16-9-6-14(7-10-16)20-15-8-11-17(19-12-15)18(22)21-13-4-2-3-5-13/h6-13,20H,2-5H2,1H3,(H,21,22).
What are the key properties of N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide?
N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(4-methoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109182280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).