3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide

C21H26N2O — CID 30099813

IUPAC3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide
SMILESC[C@@H]1CCCN(CCC(=O)Nc2ccccc2-c2ccccc2)C1
InChIInChI=1S/C21H26N2O/c1-17-8-7-14-23(16-17)15-13-21(24)22-20-12-6-5-11-19(20)18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3,(H,22,24)/t17-/m1/s1
InChIKeySRYWGXGRTKKXAI-QGZVFWFLSA-N
MW322.45 g/mol
LogP4.41
Rot. Bonds5

About 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide

3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide (PubChem CID 30099813) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide.

Molecular Properties

Compound Name3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide
PubChem CID30099813
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide
SMILESC[C@@H]1CCCN(CCC(=O)Nc2ccccc2-c2ccccc2)C1
InChIInChI=1S/C21H26N2O/c1-17-8-7-14-23(16-17)15-13-21(24)22-20-12-6-5-11-19(20)18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3,(H,22,24)/t17-/m1/s1
InChIKeySRYWGXGRTKKXAI-QGZVFWFLSA-N
XLogP4.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
CID 3145302
3-[(3S)-3-methylpiperidin-1-yl]-N-phenylpropanamide
CID 739976
3-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(2-phenylphenyl)propanamide
CID 24589351
3-(3-methylpiperidin-1-yl)-N-(4-phenoxyphenyl)propanamide
CID 109032975
3-(3-methylpiperidin-1-yl)-1-(4-phenylphenyl)propan-1-one
CID 82051046
2-[3-(3-methylpiperidin-1-yl)propanoylamino]-2-phenylacetic acid
CID 53215856
N-(4-chloro-2-methylphenyl)-3-(3-methylpiperidin-1-yl)propanamide
CID 109032944
N-(3-methylphenyl)-3-[(3R)-3-methylpiperidin-1-yl]propanamide
CID 739962
N-(3-methylphenyl)-3-(3-methylpiperidin-1-yl)propanamide;hydrochloride
CID 24747038
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-phenylphenyl)propanamide
CID 24596314
N-(2-aminophenyl)-3-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 43590088
N-(3,4-difluorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
CID 3145276

Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide?
The IUPAC name of 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide (CID 30099813) is 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide.
What is the SMILES notation for 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide?
The canonical SMILES for 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide is C[C@@H]1CCCN(CCC(=O)Nc2ccccc2-c2ccccc2)C1.
What is the InChIKey of 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide?
The InChIKey is SRYWGXGRTKKXAI-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H26N2O/c1-17-8-7-14-23(16-17)15-13-21(24)22-20-12-6-5-11-19(20)18-9-3-2-4-10-18/h2-6,9-12,17H,7-8,13-16H2,1H3,(H,22,24)/t17-/m1/s1.
What are the key properties of 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide?
3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide has a molecular weight of 322.45 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenylphenyl)propanamide is sourced from PubChem (CID 30099813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).