3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide

C19H24N2O — CID 78775690

IUPAC3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide
SMILESCCC(C)C(C(=O)NC(C)c1ccncc1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-14(2)18(17-8-6-5-7-9-17)19(22)21-15(3)16-10-12-20-13-11-16/h5-15,18H,4H2,1-3H3,(H,21,22)
InChIKeyBGULICSLHQZFQS-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.09
Rot. Bonds6

About 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide

3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide (PubChem CID 78775690) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide.

Molecular Properties

Compound Name3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide
PubChem CID78775690
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide
SMILESCCC(C)C(C(=O)NC(C)c1ccncc1)c1ccccc1
InChIInChI=1S/C19H24N2O/c1-4-14(2)18(17-8-6-5-7-9-17)19(22)21-15(3)16-10-12-20-13-11-16/h5-15,18H,4H2,1-3H3,(H,21,22)
InChIKeyBGULICSLHQZFQS-UHFFFAOYSA-N
XLogP4.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,3-dihydroxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 65315116
N-(1-bromopropan-2-yl)-3-methyl-2-phenylpentanamide
CID 114310573
(2S)-2-methyl-N-[(1S)-1-phenylethyl]butanamide
CID 16753350
2-amino-3-methyl-N-(1-phenylethyl)pentanamide
CID 21475942
(2S,3S)-2-amino-3-methyl-N-[(1R)-1-phenylethyl]pentanamide
CID 11565273
(2S,3S)-2-amino-3-methyl-N-[(1R)-1-phenylethyl]pentanamide;hydrochloride
CID 11565272
(2R,3R)-3-methyl-2-phenyl-N-(1,3-thiazol-2-yl)pentanamide
CID 8762760
N-[(1R)-1-phenylethyl]pyridine-4-carboxamide
CID 730033
N-(1-chloro-3-methoxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 106183441
phenyl N-[(1S)-1-pyridin-4-ylethyl]carbamate
CID 81409571
2,2-dichloro-N-(1-phenylethyl)acetamide
CID 2841890
3-amino-2-methyl-N-[(1R)-1-pyridin-4-ylethyl]propanamide
CID 81409558

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide?
The IUPAC name of 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide (CID 78775690) is 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide.
What is the SMILES notation for 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide?
The canonical SMILES for 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide is CCC(C)C(C(=O)NC(C)c1ccncc1)c1ccccc1.
What is the InChIKey of 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide?
The InChIKey is BGULICSLHQZFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-14(2)18(17-8-6-5-7-9-17)19(22)21-15(3)16-10-12-20-13-11-16/h5-15,18H,4H2,1-3H3,(H,21,22).
What are the key properties of 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide?
3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide has a molecular weight of 296.41 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-phenyl-N-(1-pyridin-4-ylethyl)pentanamide is sourced from PubChem (CID 78775690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).