N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide

C13H15N3O2 — CID 113023557

IUPACN-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
SMILESCC(C)Nc1ccc(NC(=O)c2ccco2)nc1
InChIInChI=1S/C13H15N3O2/c1-9(2)15-10-5-6-12(14-8-10)16-13(17)11-4-3-7-18-11/h3-9,15H,1-2H3,(H,14,16,17)
InChIKeySPYHSHAKEOYXTO-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.75
Rot. Bonds4

About N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide

N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide (PubChem CID 113023557) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
PubChem CID113023557
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
SMILESCC(C)Nc1ccc(NC(=O)c2ccco2)nc1
InChIInChI=1S/C13H15N3O2/c1-9(2)15-10-5-6-12(14-8-10)16-13(17)11-4-3-7-18-11/h3-9,15H,1-2H3,(H,14,16,17)
InChIKeySPYHSHAKEOYXTO-UHFFFAOYSA-N
XLogP2.75
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[5-(propan-2-ylamino)-2-pyridinyl]furan-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

N-[5-(4-propan-2-ylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032758
N-[5-(butanoylamino)-2-pyridinyl]furan-2-carboxamide
CID 1452808
N-[5-(3,4-dimethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032100
N-[5-(3-methylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113031417
N-[5-(2-ethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032400
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113028255
N-[5-(3-phenylpropylamino)-2-pyridinyl]furan-2-carboxamide
CID 113029807
N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
CID 113027750
N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
CID 113034810
N-[5-(4-phenoxyanilino)-2-pyridinyl]furan-2-carboxamide
CID 113035819
N-[6-(3-acetamidoanilino)-3-pyridinyl]furan-2-carboxamide
CID 113020477
N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]furan-2-carboxamide
CID 113027322

Frequently Asked Questions

What is the IUPAC name of N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide (CID 113023557) is N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide is CC(C)Nc1ccc(NC(=O)c2ccco2)nc1.
What is the InChIKey of N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide?
The InChIKey is SPYHSHAKEOYXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9(2)15-10-5-6-12(14-8-10)16-13(17)11-4-3-7-18-11/h3-9,15H,1-2H3,(H,14,16,17).
What are the key properties of N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide?
N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113023557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).