2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide

C18H16N2O2 — CID 46554509

IUPAC2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC(c1ccccc1)c1ccccn1
InChIInChI=1S/C18H16N2O2/c1-13-15(10-12-22-13)18(21)20-17(14-7-3-2-4-8-14)16-9-5-6-11-19-16/h2-12,17H,1H3,(H,20,21)
InChIKeyQQHVCBJFYGGWMQ-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.50
Rot. Bonds4

About 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide

2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide (PubChem CID 46554509) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide
PubChem CID46554509
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC(c1ccccc1)c1ccccn1
InChIInChI=1S/C18H16N2O2/c1-13-15(10-12-22-13)18(21)20-17(14-7-3-2-4-8-14)16-9-5-6-11-19-16/h2-12,17H,1H3,(H,20,21)
InChIKeyQQHVCBJFYGGWMQ-UHFFFAOYSA-N
XLogP3.50
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethyl-N-[phenyl(pyridin-2-yl)methyl]-1-propan-2-ylpyrrole-3-carboxamide
CID 78779504
5-methyl-1-phenyl-N-[(S)-phenyl(pyridin-2-yl)methyl]pyrazole-4-carboxamide
CID 51927508
N-[phenyl(pyridin-2-yl)methyl]-2-(trifluoromethyl)benzamide
CID 44765282
2,5-difluoro-N-[(S)-phenyl(pyridin-2-yl)methyl]benzamide
CID 51885946
2,3-dimethyl-N-[phenyl(pyridin-2-yl)methyl]quinoxaline-6-carboxamide
CID 134052696
2,4-dimethoxy-N-[phenyl(pyridin-2-yl)methyl]benzamide
CID 44765343
N-[(R)-(4-fluorophenyl)-pyridin-2-ylmethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 95907078
5-chloro-2-methoxy-N-[(S)-phenyl(pyridin-2-yl)methyl]benzamide
CID 93157403
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-2-methylfuran-3-carboxamide
CID 61119424
3,5-dimethoxy-N-[(R)-phenyl(pyridin-2-yl)methyl]benzamide
CID 25392445
1-(4-bromophenyl)-5-methyl-N-[phenyl(pyridin-2-yl)methyl]pyrazole-4-carboxamide
CID 46554617
3-methyl-N-[(S)-phenyl(pyridin-2-yl)methyl]butanamide
CID 36947465

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide (CID 46554509) is 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide is Cc1occc1C(=O)NC(c1ccccc1)c1ccccn1.
What is the InChIKey of 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide?
The InChIKey is QQHVCBJFYGGWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-13-15(10-12-22-13)18(21)20-17(14-7-3-2-4-8-14)16-9-5-6-11-19-16/h2-12,17H,1H3,(H,20,21).
What are the key properties of 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide?
2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[phenyl(pyridin-2-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 46554509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).