2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide

C13H18N2O — CID 62397765

IUPAC2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide
SMILESCC(NC1CC1C)C(=O)Nc1ccccc1
InChIInChI=1S/C13H18N2O/c1-9-8-12(9)14-10(2)13(16)15-11-6-4-3-5-7-11/h3-7,9-10,12,14H,8H2,1-2H3,(H,15,16)
InChIKeyWLOYTHHGORSREI-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.01
Rot. Bonds4

About 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide

2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide (PubChem CID 62397765) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide
PubChem CID62397765
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide
SMILESCC(NC1CC1C)C(=O)Nc1ccccc1
InChIInChI=1S/C13H18N2O/c1-9-8-12(9)14-10(2)13(16)15-11-6-4-3-5-7-11/h3-7,9-10,12,14H,8H2,1-2H3,(H,15,16)
InChIKeyWLOYTHHGORSREI-UHFFFAOYSA-N
XLogP2.01
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-methylcyclopentyl)amino]-N-phenylpropanamide
CID 115889728
2-(2,3-dihydro-1H-inden-2-ylamino)-N-phenylpropanamide
CID 103830707
2-[(2-methylsulfanylcyclohexyl)amino]-N-phenylpropanamide
CID 103902064
(2S)-2-[[(2S,3R)-1-methyl-2-phenylpyrrolidin-3-yl]amino]-N-phenylpropanamide
CID 124863962
(2S)-2-(methylamino)-N-phenylpropanamide;hydrochloride
CID 70254304
2-(2,3-dihydro-1-benzofuran-3-ylamino)-N-phenylpropanamide
CID 62064676
(2S)-N-(4-acetamidophenyl)-2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]propanamide
CID 11946761
(2S)-N-(4-acetamidophenyl)-2-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]propanamide
CID 11946763
4-[[(2S)-2-[[(1R,2R,3R)-2,3-dimethylcyclohexyl]amino]propanoyl]amino]benzamide
CID 11939553
(2R)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-phenylpropanamide
CID 100844501
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-N-phenylpropanamide
CID 115454689
2-[(2,2-dimethylcyclohexyl)amino]-N-phenylpropanamide
CID 79870022

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide?
The IUPAC name of 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide (CID 62397765) is 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide.
What is the SMILES notation for 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide?
The canonical SMILES for 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide is CC(NC1CC1C)C(=O)Nc1ccccc1.
What is the InChIKey of 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide?
The InChIKey is WLOYTHHGORSREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-8-12(9)14-10(2)13(16)15-11-6-4-3-5-7-11/h3-7,9-10,12,14H,8H2,1-2H3,(H,15,16).
What are the key properties of 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide?
2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide has a molecular weight of 218.30 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylcyclopropyl)amino]-N-phenylpropanamide is sourced from PubChem (CID 62397765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).