N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide

C14H20N2O — CID 63107544

IUPACN-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NCC1CC1
InChIInChI=1S/C14H20N2O/c1-10(2)16-13-6-4-3-5-12(13)14(17)15-9-11-7-8-11/h3-6,10-11,16H,7-9H2,1-2H3,(H,15,17)
InChIKeyWHELONNMPOLWTI-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.65
Rot. Bonds5

About N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide

N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide (PubChem CID 63107544) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
PubChem CID63107544
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)NCC1CC1
InChIInChI=1S/C14H20N2O/c1-10(2)16-13-6-4-3-5-12(13)14(17)15-9-11-7-8-11/h3-6,10-11,16H,7-9H2,1-2H3,(H,15,17)
InChIKeyWHELONNMPOLWTI-UHFFFAOYSA-N
XLogP2.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide 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

N-[(1-methylpiperidin-3-yl)methyl]-2-(propan-2-ylamino)benzamide
CID 63108415
2-(propan-2-ylamino)-N-(thian-2-ylmethyl)benzamide
CID 80612321
N-ethyl-2-(propan-2-ylamino)benzamide
CID 63107552
N-[(4-ethylcyclohexyl)methyl]-2-hydrazinylbenzamide
CID 62241479
N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide
CID 55177665
2-(propan-2-ylamino)-N-propylbenzamide
CID 63107529
2-(ethylamino)-N-[(4-methylcyclohexyl)methyl]benzamide
CID 63244405
methyl 3-[[2-(propan-2-ylamino)benzoyl]amino]propanoate
CID 63108007
N-[(4-methylcyclohexyl)methyl]-2-(propylamino)benzamide
CID 63501540
2-(propan-2-ylamino)-N-prop-2-enylbenzamide
CID 63101364
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
N-(3-aminopropyl)-2-(propan-2-ylamino)benzamide
CID 63107952

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide (CID 63107544) is N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide is CC(C)Nc1ccccc1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide?
The InChIKey is WHELONNMPOLWTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(2)16-13-6-4-3-5-12(13)14(17)15-9-11-7-8-11/h3-6,10-11,16H,7-9H2,1-2H3,(H,15,17).
What are the key properties of N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide?
N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide has a molecular weight of 232.33 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 63107544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).