2-(cyclopropylamino)-N-(4-methylphenyl)propanamide

C13H18N2O — CID 60638669

IUPAC2-(cyclopropylamino)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)NC2CC2)cc1
InChIInChI=1S/C13H18N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)14-11-7-8-11/h3-6,10-11,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyDASJWNDHKWGLEK-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.07
Rot. Bonds4

About 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide

2-(cyclopropylamino)-N-(4-methylphenyl)propanamide (PubChem CID 60638669) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-(4-methylphenyl)propanamide
PubChem CID60638669
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(cyclopropylamino)-N-(4-methylphenyl)propanamide
SMILESCc1ccc(NC(=O)C(C)NC2CC2)cc1
InChIInChI=1S/C13H18N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)14-11-7-8-11/h3-6,10-11,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyDASJWNDHKWGLEK-UHFFFAOYSA-N
XLogP2.07
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 ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopentylamino)-N-(4-methylphenyl)propanamide
CID 60638781
2-[(3,4-dimethylcyclohexyl)amino]-N-(4-methylphenyl)propanamide
CID 64744033
2-(dicyclopropylmethylamino)-N-(4-methylphenyl)propanamide
CID 60714008
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(4-methylphenyl)propanamide
CID 114629421
N-cyclopropyl-2-(4-methylanilino)propanamide
CID 43085895
2-[(3-methylcyclopentyl)amino]-N-phenylpropanamide
CID 115889728
2-(ethylamino)-N-(4-methylphenyl)propanamide
CID 3808367
(2S)-2-(cyclohexylamino)-N-(4-morpholin-4-ylphenyl)propanamide
CID 7928372
2-(2,3-dihydro-1H-inden-2-ylamino)-N-phenylpropanamide
CID 103830707
N-[4-[2-(cyclopropylamino)propanoyl]phenyl]acetamide;hydrochloride
CID 3024747
N-(4-methylphenyl)-2-(propylamino)propanamide
CID 60638636
2-[(1-ethylcyclopropyl)methylamino]-N-(4-methylphenyl)propanamide
CID 103734805

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide?
The IUPAC name of 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide (CID 60638669) is 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide?
The canonical SMILES for 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide is Cc1ccc(NC(=O)C(C)NC2CC2)cc1.
What is the InChIKey of 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide?
The InChIKey is DASJWNDHKWGLEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-3-5-12(6-4-9)15-13(16)10(2)14-11-7-8-11/h3-6,10-11,14H,7-8H2,1-2H3,(H,15,16).
What are the key properties of 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide?
2-(cyclopropylamino)-N-(4-methylphenyl)propanamide has a molecular weight of 218.30 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 60638669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).