5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide

C15H25N3O — CID 109181275

IUPAC5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1ccc(NCC(C)C)cn1
InChIInChI=1S/C15H25N3O/c1-4-5-6-9-16-15(19)14-8-7-13(11-18-14)17-10-12(2)3/h7-8,11-12,17H,4-6,9-10H2,1-3H3,(H,16,19)
InChIKeyHIGXRNVTGQYFBV-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.07
Rot. Bonds8

About 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide

5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide (PubChem CID 109181275) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
PubChem CID109181275
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
SMILESCCCCCNC(=O)c1ccc(NCC(C)C)cn1
InChIInChI=1S/C15H25N3O/c1-4-5-6-9-16-15(19)14-8-7-13(11-18-14)17-10-12(2)3/h7-8,11-12,17H,4-6,9-10H2,1-3H3,(H,16,19)
InChIKeyHIGXRNVTGQYFBV-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
CID 104641912
5-(butylamino)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109180889
5-(pentylamino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109194843
N-butyl-5-(2-methylpropylamino)pyrazine-2-carboxamide
CID 109272339
N-pentyl-5-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109191345
5-(3-fluoroanilino)-N-pentylpyridine-2-carboxamide
CID 109195788
N-[(2-fluorophenyl)methyl]-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181224
5-(4-cyanoanilino)-N-pentylpyridine-2-carboxamide
CID 109195813
N-(3,4-dimethylphenyl)-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181294
N-(2-propan-2-yloxyethyl)-5-(propylamino)pyridine-2-carboxamide
CID 104765582
N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide
CID 109272804
5-(3-acetamidoanilino)-N-pentylpyridine-2-carboxamide
CID 109195775

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide?
The IUPAC name of 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide (CID 109181275) is 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide.
What is the SMILES notation for 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide?
The canonical SMILES for 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide is CCCCCNC(=O)c1ccc(NCC(C)C)cn1.
What is the InChIKey of 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide?
The InChIKey is HIGXRNVTGQYFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-5-6-9-16-15(19)14-8-7-13(11-18-14)17-10-12(2)3/h7-8,11-12,17H,4-6,9-10H2,1-3H3,(H,16,19).
What are the key properties of 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide?
5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.07, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide is sourced from PubChem (CID 109181275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).