5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide

C14H19N3O — CID 109180232

IUPAC5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide
SMILESC=CCNC(=O)c1ccc(NC2CCCC2)cn1
InChIInChI=1S/C14H19N3O/c1-2-9-15-14(18)13-8-7-12(10-16-13)17-11-5-3-4-6-11/h2,7-8,10-11,17H,1,3-6,9H2,(H,15,18)
InChIKeyYVQVNLJBYJIHIK-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.35
Rot. Bonds5

About 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide

5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide (PubChem CID 109180232) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide
PubChem CID109180232
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide
SMILESC=CCNC(=O)c1ccc(NC2CCCC2)cn1
InChIInChI=1S/C14H19N3O/c1-2-9-15-14(18)13-8-7-12(10-16-13)17-11-5-3-4-6-11/h2,7-8,10-11,17H,1,3-6,9H2,(H,15,18)
InChIKeyYVQVNLJBYJIHIK-UHFFFAOYSA-N
XLogP2.35
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(cycloheptylamino)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109185339
5-(cycloheptylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181080
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
N-[2-(4-chlorophenyl)ethyl]-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182393
5-(cyclohexylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109183067
N-(4-tert-butylphenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182449
5-(4-methylanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180319
5-(4-acetamidoanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109180372
5-(cyclopentylamino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109182359
N-[(2-chlorophenyl)methyl]-5-(cyclohexylamino)pyridine-2-carboxamide
CID 109183086
5-(cyclohexylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109183069

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide?
The IUPAC name of 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide (CID 109180232) is 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide?
The canonical SMILES for 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide is C=CCNC(=O)c1ccc(NC2CCCC2)cn1.
What is the InChIKey of 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide?
The InChIKey is YVQVNLJBYJIHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-2-9-15-14(18)13-8-7-12(10-16-13)17-11-5-3-4-6-11/h2,7-8,10-11,17H,1,3-6,9H2,(H,15,18).
What are the key properties of 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide?
5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide has a molecular weight of 245.33 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopentylamino)-N-prop-2-enylpyridine-2-carboxamide is sourced from PubChem (CID 109180232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).