3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide

C13H19N3O — CID 103387471

IUPAC3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide
SMILESCC(CN)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C13H19N3O/c1-9(8-14)15-12-4-2-3-10(7-12)13(17)16-11-5-6-11/h2-4,7,9,11,15H,5-6,8,14H2,1H3,(H,16,17)
InChIKeyOZCRTSLALAYHCQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.34
Rot. Bonds5

About 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide

3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide (PubChem CID 103387471) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide
PubChem CID103387471
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide
SMILESCC(CN)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C13H19N3O/c1-9(8-14)15-12-4-2-3-10(7-12)13(17)16-11-5-6-11/h2-4,7,9,11,15H,5-6,8,14H2,1H3,(H,16,17)
InChIKeyOZCRTSLALAYHCQ-UHFFFAOYSA-N
XLogP1.34
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[(2S)-2-aminopropanoyl]amino]-N-cyclopropylbenzamide
CID 78969031
methyl 3-[[(2S)-1-aminopropan-2-yl]amino]benzoate
CID 178109446
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
3-(carbamoylamino)-N-cyclopropylbenzamide
CID 9210111
N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide
CID 9361250
N-(1-amino-4-methylpentan-2-yl)-3-(cyclopropylcarbamoylamino)benzamide
CID 119588727
3-[1-(5-chlorothiophen-2-yl)ethylamino]-N-cyclopropylbenzamide
CID 43439080
3-[[2-[(2-amino-2-oxoethyl)-propan-2-ylamino]acetyl]amino]-N-cyclopropylbenzamide
CID 18127274
3-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389328
3-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]benzamide
CID 103600833
2-amino-N-[3-(cyclopropylcarbamoyl)phenyl]butanediamide
CID 61252820
3-[(3-chloro-2-methylpropyl)sulfonylamino]-N-cyclopropylbenzamide
CID 79555715

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide?
The IUPAC name of 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide (CID 103387471) is 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide.
What is the SMILES notation for 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide?
The canonical SMILES for 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide is CC(CN)Nc1cccc(C(=O)NC2CC2)c1.
What is the InChIKey of 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide?
The InChIKey is OZCRTSLALAYHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9(8-14)15-12-4-2-3-10(7-12)13(17)16-11-5-6-11/h2-4,7,9,11,15H,5-6,8,14H2,1H3,(H,16,17).
What are the key properties of 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide?
3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide has a molecular weight of 233.31 g/mol, XLogP of 1.34, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide is sourced from PubChem (CID 103387471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).