4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide

C18H20N2O — CID 174857950

IUPAC4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide
SMILESCc1ccccc1CNC1CC1c1ccc(C(N)=O)cc1
InChIInChI=1S/C18H20N2O/c1-12-4-2-3-5-15(12)11-20-17-10-16(17)13-6-8-14(9-7-13)18(19)21/h2-9,16-17,20H,10-11H2,1H3,(H2,19,21)
InChIKeyOVIGSGJGFMTRIO-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.74
Rot. Bonds5

About 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide

4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide (PubChem CID 174857950) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide.

Molecular Properties

Compound Name4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide
PubChem CID174857950
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide
SMILESCc1ccccc1CNC1CC1c1ccc(C(N)=O)cc1
InChIInChI=1S/C18H20N2O/c1-12-4-2-3-5-15(12)11-20-17-10-16(17)13-6-8-14(9-7-13)18(19)21/h2-9,16-17,20H,10-11H2,1H3,(H2,19,21)
InChIKeyOVIGSGJGFMTRIO-UHFFFAOYSA-N
XLogP2.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[(2-chlorophenyl)methylamino]cyclopropyl]benzamide
CID 174857995
N-benzyl-4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide;2,2,2-trifluoroacetic acid
CID 118305002
4-[2-[(3-cyanophenyl)methylamino]cyclopropyl]benzamide
CID 174858317
4-[[(3-hydroxycyclobutyl)amino]methyl]-3-methylbenzamide
CID 114480489
trans-(1R,2R)-1-N,2-N-bis[(2-methylphenyl)methyl]cyclohexane-1,2-diamine
CID 15739492
N-(2-aminocyclopropyl)-2-(2-methylphenyl)acetamide
CID 43593844
[2-(benzylcarbamoyl)-5-[2-[(2-methylphenyl)methylamino]cyclopropyl]phenyl] 2,2,2-trifluoroacetate
CID 140688620
2-[[4-[[(2-phenylcyclopropyl)amino]methyl]triazol-1-yl]methyl]benzamide
CID 174938653
3-methyl-4-[[(2-phenylcyclopropyl)amino]methyl]benzonitrile
CID 114480146
3-[[(2-phenylcyclopropyl)amino]methyl]thiophene-2-carboxylic acid
CID 103244644
[(2-methylphenyl)methylamino]urea
CID 70588726
2-[(2-methylphenyl)methylamino]oxyacetamide
CID 112672645

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide?
The IUPAC name of 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide (CID 174857950) is 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide.
What is the SMILES notation for 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide?
The canonical SMILES for 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide is Cc1ccccc1CNC1CC1c1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide?
The InChIKey is OVIGSGJGFMTRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-4-2-3-5-15(12)11-20-17-10-16(17)13-6-8-14(9-7-13)18(19)21/h2-9,16-17,20H,10-11H2,1H3,(H2,19,21).
What are the key properties of 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide?
4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide has a molecular weight of 280.37 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-methylphenyl)methylamino]cyclopropyl]benzamide is sourced from PubChem (CID 174857950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).