N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide

C18H20N2O3 — CID 94450217

IUPACN-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESC[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2ccc[nH]c2=O)C2CC2)o1
InChIInChI=1S/C18H20N2O3/c1-11-9-15(11)16-7-6-13(23-16)10-20(12-4-5-12)18(22)14-3-2-8-19-17(14)21/h2-3,6-8,11-12,15H,4-5,9-10H2,1H3,(H,19,21)/t11-,15-/m1/s1
InChIKeyJYHTWVGHXOGMBX-IAQYHMDHSA-N
MW312.37 g/mol
LogP2.90
Rot. Bonds5

About N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide

N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 94450217) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID94450217
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESC[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2ccc[nH]c2=O)C2CC2)o1
InChIInChI=1S/C18H20N2O3/c1-11-9-15(11)16-7-6-13(23-16)10-20(12-4-5-12)18(22)14-3-2-8-19-17(14)21/h2-3,6-8,11-12,15H,4-5,9-10H2,1H3,(H,19,21)/t11-,15-/m1/s1
InChIKeyJYHTWVGHXOGMBX-IAQYHMDHSA-N
XLogP2.90
TPSA66.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

1-cyclopropyl-3-methyl-1-[[5-[(1S,2S)-2-methylcyclopropyl]furan-2-yl]methyl]urea
CID 94160880
N-cyclopropyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 32590253
N-cyclopropyl-5-methyl-N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]-1H-pyrazole-3-carboxamide
CID 94578733
N-cyclopropyl-3-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-1,2-oxazole-5-carboxamide
CID 51079314
N-cyclopropyl-N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]-1,2,5-thiadiazole-3-carboxamide
CID 95271429
N-cyclopropyl-2-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]-1H-pyridine-3-carboxamide
CID 25352952
N-cyclopropyl-6-methyl-N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]-3,4-dihydro-2H-pyran-5-carboxamide
CID 99577588
N-(4-aminocyclohexyl)-N-ethyl-2-oxo-1H-pyridine-3-carboxamide
CID 79116433
(2R)-N-cyclopropyl-N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-1,1-dioxothiane-2-carboxamide
CID 124744236
(2S)-N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-1,1-dioxothiane-2-carboxamide
CID 97352107
1-cyclopropyl-1-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]-3-(oxan-4-yl)urea
CID 71938740
1-cyclopropyl-1-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-3-[(3R)-2-oxoazepan-3-yl]urea
CID 94182837

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide (CID 94450217) is N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide is C[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2ccc[nH]c2=O)C2CC2)o1.
What is the InChIKey of N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is JYHTWVGHXOGMBX-IAQYHMDHSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-11-9-15(11)16-7-6-13(23-16)10-20(12-4-5-12)18(22)14-3-2-8-19-17(14)21/h2-3,6-8,11-12,15H,4-5,9-10H2,1H3,(H,19,21)/t11-,15-/m1/s1.
What are the key properties of N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide?
N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 94450217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).