6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide

C16H16N2O — CID 73011269

IUPAC6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccccc2)cn1
InChIInChI=1S/C16H16N2O/c1-11-7-8-13(10-17-11)16(19)18-15-9-14(15)12-5-3-2-4-6-12/h2-8,10,14-15H,9H2,1H3,(H,18,19)/t14-,15+/m0/s1
InChIKeySUCDADQDPNNWAN-LSDHHAIUSA-N
MW252.32 g/mol
LogP2.68
Rot. Bonds3

About 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide

6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide (PubChem CID 73011269) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide
PubChem CID73011269
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccccc2)cn1
InChIInChI=1S/C16H16N2O/c1-11-7-8-13(10-17-11)16(19)18-15-9-14(15)12-5-3-2-4-6-12/h2-8,10,14-15H,9H2,1H3,(H,18,19)/t14-,15+/m0/s1
InChIKeySUCDADQDPNNWAN-LSDHHAIUSA-N
XLogP2.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-hydrazinyl-N-(2-phenylcyclopropyl)pyridine-3-carboxamide
CID 62248555
N-[(1S,2R)-2-phenylcyclopropyl]benzamide
CID 7350127
3-amino-5-methyl-N-(2-phenylcyclopropyl)pyrazine-2-carboxamide
CID 10038673
4-fluoro-3-methyl-N-(2-phenylcyclopropyl)benzamide
CID 63213326
2-methyl-N-(2-phenylcyclopropyl)-1,3-thiazole-5-carboxamide
CID 10106577
N-[(1R,2R)-2-phenylcyclopropyl]acetamide
CID 6954168
4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide
CID 62249097
N-[(3R,4S,5R)-4,5-dihydroxyoxan-3-yl]-6-methylpyridine-3-carboxamide
CID 155996088
trans-(1R,3R)-3-[(6-methylpyridine-3-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 97318292
3-methyl-N-[(1S,2R)-2-phenylcyclopropyl]-1,2-thiazole-4-carboxamide
CID 134108990
6-methyl-N-[(1S,2R,4R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyrrolidine-1-carbonyl)cyclopentyl]pyridine-3-carboxamide
CID 146069732
6-methyl-N-[(1S,2R)-2-(trifluoromethyl)cyclohexyl]pyridine-3-carboxamide
CID 52501616

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide (CID 73011269) is 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide is Cc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccccc2)cn1.
What is the InChIKey of 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide?
The InChIKey is SUCDADQDPNNWAN-LSDHHAIUSA-N. The full InChI is InChI=1S/C16H16N2O/c1-11-7-8-13(10-17-11)16(19)18-15-9-14(15)12-5-3-2-4-6-12/h2-8,10,14-15H,9H2,1H3,(H,18,19)/t14-,15+/m0/s1.
What are the key properties of 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide?
6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide is sourced from PubChem (CID 73011269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).