N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

C21H20N2O3 — CID 38253946

IUPACN-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C21H20N2O3/c24-20-8-4-5-13-22(20)15-18-11-12-19(26-18)21(25)23(17-9-10-17)14-16-6-2-1-3-7-16/h1-8,11-13,17H,9-10,14-15H2
InChIKeyCHSPACFIXSCXAX-UHFFFAOYSA-N
MW348.40 g/mol
LogP3.29
Rot. Bonds6

About N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide

N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (PubChem CID 38253946) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
PubChem CID38253946
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
SMILESO=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C21H20N2O3/c24-20-8-4-5-13-22(20)15-18-11-12-19(26-18)21(25)23(17-9-10-17)14-16-6-2-1-3-7-16/h1-8,11-13,17H,9-10,14-15H2
InChIKeyCHSPACFIXSCXAX-UHFFFAOYSA-N
XLogP3.29
TPSA55.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
CID 37483914
N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 134024767
N-(2-hydroxyethyl)-5-[(2-oxo-1-pyridinyl)methyl]-N-propylfuran-2-carboxamide
CID 110887129
(2S,3aS,7aR)-1-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 125152047
1-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]piperidine-4-carboxamide
CID 71899552
(3S)-1-[5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbonyl]piperidine-3-carboxylic acid
CID 124703095
N-[(4-fluorophenyl)-phenylmethyl]-N-methyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 134024895
1-[[5-[(3S,5S)-3,5-dimethylpiperazine-1-carbonyl]furan-2-yl]methyl]pyridin-2-one
CID 124589659
5-[(2-oxo-1-pyridinyl)methyl]-N-[(1-phenylcyclopropyl)methyl]furan-2-carboxamide
CID 33284170
N-[(2,4-difluorophenyl)methyl]-N-methyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 38230002
N-benzyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 134024468
5-[(2-oxo-1-pyridinyl)methyl]-N-prop-2-enylfuran-2-carboxamide
CID 47141528

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The IUPAC name of N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide (CID 38253946) is N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is O=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
The InChIKey is CHSPACFIXSCXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c24-20-8-4-5-13-22(20)15-18-11-12-19(26-18)21(25)23(17-9-10-17)14-16-6-2-1-3-7-16/h1-8,11-13,17H,9-10,14-15H2.
What are the key properties of N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide?
N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide has a molecular weight of 348.40 g/mol, XLogP of 3.29, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 38253946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).