N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide

C20H25N3O2 — CID 109225918

IUPACN-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1ccc(CCNc2cncc(C(=O)NC3CCCC3)c2)cc1
InChIInChI=1S/C20H25N3O2/c1-25-19-8-6-15(7-9-19)10-11-22-18-12-16(13-21-14-18)20(24)23-17-4-2-3-5-17/h6-9,12-14,17,22H,2-5,10-11H2,1H3,(H,23,24)
InChIKeyGBPCTVQAFJTTQL-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.42
Rot. Bonds7

About N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide

N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide (PubChem CID 109225918) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
PubChem CID109225918
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1ccc(CCNc2cncc(C(=O)NC3CCCC3)c2)cc1
InChIInChI=1S/C20H25N3O2/c1-25-19-8-6-15(7-9-19)10-11-22-18-12-16(13-21-14-18)20(24)23-17-4-2-3-5-17/h6-9,12-14,17,22H,2-5,10-11H2,1H3,(H,23,24)
InChIKeyGBPCTVQAFJTTQL-UHFFFAOYSA-N
XLogP3.42
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-5-[2-(4-methoxyphenoxy)ethylamino]pyridine-3-carboxamide
CID 109239199
5-(cyclohexylamino)-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109226851
N-cyclohexyl-2-[2-(4-methoxyphenyl)ethylamino]pyrimidine-5-carboxamide
CID 109250312
N-(2-methoxyethyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109227669
N-cyclopentyl-4-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109204026
N-(4-acetylphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236959
N-cycloheptyl-2-[2-(4-methoxyphenyl)ethylamino]pyridine-4-carboxamide
CID 109173025
N-cyclopropyl-5-[2-(4-sulfamoylphenyl)ethylamino]pyridine-3-carboxamide
CID 109223606
N-[2-(2-fluorophenyl)ethyl]-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236233
N-(3-fluorophenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236961
N-cyclopentyl-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109226008
N-(2-methoxy-5-methylphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236957

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide (CID 109225918) is N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide is COc1ccc(CCNc2cncc(C(=O)NC3CCCC3)c2)cc1.
What is the InChIKey of N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The InChIKey is GBPCTVQAFJTTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-25-19-8-6-15(7-9-19)10-11-22-18-12-16(13-21-14-18)20(24)23-17-4-2-3-5-17/h6-9,12-14,17,22H,2-5,10-11H2,1H3,(H,23,24).
What are the key properties of N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 3.42, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109225918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).