N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide

C17H16N2O — CID 18190564

IUPACN-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C17H16N2O/c1-2-12-18-13-17(20)19-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h1,3-11,18H,12-13H2,(H,19,20)
InChIKeyBYXNTGCEDUWREV-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.51
Rot. Bonds5

About N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide

N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide (PubChem CID 18190564) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide.

Molecular Properties

Compound NameN-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide
PubChem CID18190564
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide
SMILESC#CCNCC(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C17H16N2O/c1-2-12-18-13-17(20)19-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h1,3-11,18H,12-13H2,(H,19,20)
InChIKeyBYXNTGCEDUWREV-UHFFFAOYSA-N
XLogP2.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[[2-(prop-2-ynylamino)acetyl]amino]phenyl]acetic acid
CID 79271614
N-(2-tert-butylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78912848
N-(2,3-dimethylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78908653
2-(cyclopropylmethylamino)-N-(2-phenylphenyl)acetamide;hydrochloride
CID 119675331
N-[2-(1-hydroxyethyl)phenyl]-2-(prop-2-ynylamino)acetamide
CID 79287334
N-(2-methylsulfonylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78912870
N-(2-ethylsulfonylphenyl)-2-(prop-2-ynylamino)acetamide
CID 79287541
3-oxo-3-(2-phenylanilino)propanoic acid
CID 62230897
2-chloro-N-(2-phenylphenyl)acetamide
CID 1129350
2-(2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 9080600
N-(2-propoxyphenyl)-2-(prop-2-ynylamino)acetamide
CID 112722694
N-(2-cyano-3-methylphenyl)-2-(prop-2-ynylamino)acetamide
CID 114003133

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide?
The IUPAC name of N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide (CID 18190564) is N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide.
What is the SMILES notation for N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide?
The canonical SMILES for N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide is C#CCNCC(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide?
The InChIKey is BYXNTGCEDUWREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-12-18-13-17(20)19-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h1,3-11,18H,12-13H2,(H,19,20).
What are the key properties of N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide?
N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide has a molecular weight of 264.33 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylphenyl)-2-(prop-2-ynylamino)acetamide is sourced from PubChem (CID 18190564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).