4-(cyclopropylamino)benzamide

C10H12N2O — CID 103605968

IUPAC4-(cyclopropylamino)benzamide
SMILESNC(=O)c1ccc(NC2CC2)cc1
InChIInChI=1S/C10H12N2O/c11-10(13)7-1-3-8(4-2-7)12-9-5-6-9/h1-4,9,12H,5-6H2,(H2,11,13)
InChIKeyMIFCOJJIOIEYNY-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.36
Rot. Bonds3

About 4-(cyclopropylamino)benzamide

4-(cyclopropylamino)benzamide (PubChem CID 103605968) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 4-(cyclopropylamino)benzamide.

Molecular Properties

Compound Name4-(cyclopropylamino)benzamide
PubChem CID103605968
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name4-(cyclopropylamino)benzamide
SMILESNC(=O)c1ccc(NC2CC2)cc1
InChIInChI=1S/C10H12N2O/c11-10(13)7-1-3-8(4-2-7)12-9-5-6-9/h1-4,9,12H,5-6H2,(H2,11,13)
InChIKeyMIFCOJJIOIEYNY-UHFFFAOYSA-N
XLogP1.36
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(3-aminocyclohexyl)amino]benzamide
CID 79458720
[4-(cyclopropylamino)phenyl]urea
CID 103439135
4-[[3-(2-methylphenyl)cyclobutyl]amino]benzamide
CID 43633223
[4-(cyclopentylamino)phenyl]urea
CID 43744886
4-(cyclobutylamino)benzenecarbothioamide
CID 62415187
2-(4-carbamoylanilino)cyclopentane-1-carboxylic acid
CID 64817627
4-amino-3-(cyclopropylamino)benzamide
CID 63355783
4-[(4-tert-butylcyclohexyl)amino]benzoic acid
CID 43139224
4-[[3-(3-fluorophenyl)cyclobutyl]amino]benzamide
CID 43633216
4-(6-oxa-2-thiaspiro[4.5]decan-9-ylamino)benzamide
CID 79897402
4-[(4-aminocyclohexyl)amino]-N-(2-hydroxyethyl)benzamide
CID 79731100
6-[(4-aminocyclohexyl)amino]pyridine-3-carboxamide
CID 58337929

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylamino)benzamide?
The IUPAC name of 4-(cyclopropylamino)benzamide (CID 103605968) is 4-(cyclopropylamino)benzamide.
What is the SMILES notation for 4-(cyclopropylamino)benzamide?
The canonical SMILES for 4-(cyclopropylamino)benzamide is NC(=O)c1ccc(NC2CC2)cc1.
What is the InChIKey of 4-(cyclopropylamino)benzamide?
The InChIKey is MIFCOJJIOIEYNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c11-10(13)7-1-3-8(4-2-7)12-9-5-6-9/h1-4,9,12H,5-6H2,(H2,11,13).
What are the key properties of 4-(cyclopropylamino)benzamide?
4-(cyclopropylamino)benzamide has a molecular weight of 176.22 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylamino)benzamide is sourced from PubChem (CID 103605968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).