(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide

C23H25N3O — CID 97282614

IUPAC(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide
SMILESCc1ccccc1[C@H](CC(=O)NCCNc1cccnc1)c1ccccc1
InChIInChI=1S/C23H25N3O/c1-18-8-5-6-12-21(18)22(19-9-3-2-4-10-19)16-23(27)26-15-14-25-20-11-7-13-24-17-20/h2-13,17,22,25H,14-16H2,1H3,(H,26,27)/t22-/m1/s1
InChIKeySLZJSLRFOMSCKQ-JOCHJYFZSA-N
MW359.47 g/mol
LogP4.14
Rot. Bonds8

About (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide

(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide (PubChem CID 97282614) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide.

Molecular Properties

Compound Name(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide
PubChem CID97282614
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide
SMILESCc1ccccc1[C@H](CC(=O)NCCNc1cccnc1)c1ccccc1
InChIInChI=1S/C23H25N3O/c1-18-8-5-6-12-21(18)22(19-9-3-2-4-10-19)16-23(27)26-15-14-25-20-11-7-13-24-17-20/h2-13,17,22,25H,14-16H2,1H3,(H,26,27)/t22-/m1/s1
InChIKeySLZJSLRFOMSCKQ-JOCHJYFZSA-N
XLogP4.14
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-methylphenyl)-3-phenyl-N-(pyridin-4-ylmethyl)propanamide
CID 45207071
(3R)-3-(2-methylphenyl)-3-phenyl-N-(2-propan-2-ylsulfonylethyl)propanamide
CID 97284820
N-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)ethyl]-3-(2-methylphenyl)-3-phenylpropanamide
CID 72896575
(3R)-N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-3-(2-methylphenyl)-3-phenylpropanamide
CID 97273006
3,3-diphenyl-N-(pyridin-3-ylmethyl)propanamide
CID 690534
(2S)-4-oxo-2-phenyl-4-(pyridin-3-ylamino)butanoic acid
CID 851940
1-methyl-5-phenyl-N-[2-(pyridin-3-ylamino)ethyl]pyrrole-2-carboxamide
CID 77085057
1-[(2-methylphenyl)-phenylmethyl]-3-pyridin-3-ylthiourea
CID 133215757
4,4-diphenyl-N-pyridin-3-ylbutanamide
CID 11976417
1-(2-methylphenyl)-1-phenylpentan-3-one
CID 102348296
3-(2-fluorophenyl)-N-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]-3-phenylpropanamide
CID 72925472
3,3-diphenyl-N-propylpropanamide
CID 4638647

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide?
The IUPAC name of (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide (CID 97282614) is (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide.
What is the SMILES notation for (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide?
The canonical SMILES for (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide is Cc1ccccc1[C@H](CC(=O)NCCNc1cccnc1)c1ccccc1.
What is the InChIKey of (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide?
The InChIKey is SLZJSLRFOMSCKQ-JOCHJYFZSA-N. The full InChI is InChI=1S/C23H25N3O/c1-18-8-5-6-12-21(18)22(19-9-3-2-4-10-19)16-23(27)26-15-14-25-20-11-7-13-24-17-20/h2-13,17,22,25H,14-16H2,1H3,(H,26,27)/t22-/m1/s1.
What are the key properties of (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide?
(3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide has a molecular weight of 359.47 g/mol, XLogP of 4.14, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2-methylphenyl)-3-phenyl-N-[2-(pyridin-3-ylamino)ethyl]propanamide is sourced from PubChem (CID 97282614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).