3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide

C24H27N3O — CID 119878011

IUPAC3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
SMILESCc1cccc(CN(Cc2ccccn2)C(=O)C(C)C(N)c2ccccc2)c1
InChIInChI=1S/C24H27N3O/c1-18-9-8-10-20(15-18)16-27(17-22-13-6-7-14-26-22)24(28)19(2)23(25)21-11-4-3-5-12-21/h3-15,19,23H,16-17,25H2,1-2H3
InChIKeyATRPHXCAMKZCQP-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.25
Rot. Bonds7

About 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide

3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 119878011) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
PubChem CID119878011
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC Name3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
SMILESCc1cccc(CN(Cc2ccccn2)C(=O)C(C)C(N)c2ccccc2)c1
InChIInChI=1S/C24H27N3O/c1-18-9-8-10-20(15-18)16-27(17-22-13-6-7-14-26-22)24(28)19(2)23(25)21-11-4-3-5-12-21/h3-15,19,23H,16-17,25H2,1-2H3
InChIKeyATRPHXCAMKZCQP-UHFFFAOYSA-N
XLogP4.25
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N,2-dimethyl-3-phenyl-N-(pyridin-2-ylmethyl)propanamide;dihydrochloride
CID 119958567
2-imidazol-1-yl-N-[(3-methylphenyl)methyl]-N-(pyridin-2-ylmethyl)propanamide
CID 56788413
4-amino-N-[(3-methylphenyl)methyl]-N-(pyridin-2-ylmethyl)butanamide
CID 119878034
2-methyl-N-(pyridin-2-ylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide
CID 75379624
(2S)-2-[bis(pyridin-2-ylmethyl)amino]-N,N-bis(pyridin-2-ylmethyl)propanamide
CID 102088447
2-amino-N-ethyl-3-phenyl-N-(pyridin-2-ylmethyl)propanamide;dihydrochloride
CID 119885181
3-amino-N-[(3,4-dichlorophenyl)methyl]-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119683610
N-[(3-methylphenyl)methyl]-2-phenyl-N-propan-2-ylpropanamide
CID 50979991
N-[(3-methylphenyl)methyl]-N-propan-2-ylpyridine-2-carboxamide
CID 50971930
2-amino-N-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 68993512
2-chloro-N-methyl-2-phenyl-N-(pyridin-2-ylmethyl)acetamide
CID 43565135
3-methyl-2-[methyl-[(3-methylphenyl)methyl]carbamoyl]butanoic acid
CID 115186248

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide (CID 119878011) is 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide is Cc1cccc(CN(Cc2ccccn2)C(=O)C(C)C(N)c2ccccc2)c1.
What is the InChIKey of 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is ATRPHXCAMKZCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-18-9-8-10-20(15-18)16-27(17-22-13-6-7-14-26-22)24(28)19(2)23(25)21-11-4-3-5-12-21/h3-15,19,23H,16-17,25H2,1-2H3.
What are the key properties of 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide?
3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 373.50 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-[(3-methylphenyl)methyl]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 119878011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).