2-amino-N-(4-pyridin-4-ylphenyl)propanamide

C14H15N3O — CID 110460098

IUPAC2-amino-N-(4-pyridin-4-ylphenyl)propanamide
SMILESCC(N)C(=O)Nc1ccc(-c2ccncc2)cc1
InChIInChI=1S/C14H15N3O/c1-10(15)14(18)17-13-4-2-11(3-5-13)12-6-8-16-9-7-12/h2-10H,15H2,1H3,(H,17,18)
InChIKeyZTLNWISSPFFDNI-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.03
Rot. Bonds3

About 2-amino-N-(4-pyridin-4-ylphenyl)propanamide

2-amino-N-(4-pyridin-4-ylphenyl)propanamide (PubChem CID 110460098) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-amino-N-(4-pyridin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(4-pyridin-4-ylphenyl)propanamide
PubChem CID110460098
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-amino-N-(4-pyridin-4-ylphenyl)propanamide
SMILESCC(N)C(=O)Nc1ccc(-c2ccncc2)cc1
InChIInChI=1S/C14H15N3O/c1-10(15)14(18)17-13-4-2-11(3-5-13)12-6-8-16-9-7-12/h2-10H,15H2,1H3,(H,17,18)
InChIKeyZTLNWISSPFFDNI-UHFFFAOYSA-N
XLogP2.03
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-pyridin-4-ylpropanamide
CID 78972247
(2S)-2-amino-3,3-dimethyl-N-(4-pyridin-4-ylphenyl)butanamide
CID 175833956
N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426
(2R)-2-amino-N-(4-hydroxyphenyl)propanamide
CID 78972563
(2R)-2-amino-N-[4-(1,3-thiazol-2-yl)phenyl]propanamide
CID 54995648
(2R)-2-amino-N-(4-chlorophenyl)propanamide
CID 7183165
(2R)-2-amino-N-isoquinolin-7-ylpropanamide
CID 143835727
(2S)-2-amino-N-(3,4-dichlorophenyl)propanamide
CID 22690595
(2R)-2-amino-N-phenylpropanamide
CID 10607114
(2S)-2-(methylamino)-N-pyridin-4-ylpropanamide
CID 59361167
2-amino-N-(4-fluorophenyl)propanamide;hydrochloride
CID 56832255
(2S)-2-hydroxy-N-pyridin-4-ylpropanamide
CID 130695584

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-pyridin-4-ylphenyl)propanamide?
The IUPAC name of 2-amino-N-(4-pyridin-4-ylphenyl)propanamide (CID 110460098) is 2-amino-N-(4-pyridin-4-ylphenyl)propanamide.
What is the SMILES notation for 2-amino-N-(4-pyridin-4-ylphenyl)propanamide?
The canonical SMILES for 2-amino-N-(4-pyridin-4-ylphenyl)propanamide is CC(N)C(=O)Nc1ccc(-c2ccncc2)cc1.
What is the InChIKey of 2-amino-N-(4-pyridin-4-ylphenyl)propanamide?
The InChIKey is ZTLNWISSPFFDNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10(15)14(18)17-13-4-2-11(3-5-13)12-6-8-16-9-7-12/h2-10H,15H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-(4-pyridin-4-ylphenyl)propanamide?
2-amino-N-(4-pyridin-4-ylphenyl)propanamide has a molecular weight of 241.29 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-pyridin-4-ylphenyl)propanamide is sourced from PubChem (CID 110460098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).