N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide

C12H18N2O — CID 82507196

IUPACN-(1-aminopropan-2-yl)-N,3-dimethylbenzamide
SMILESCc1cccc(C(=O)N(C)C(C)CN)c1
InChIInChI=1S/C12H18N2O/c1-9-5-4-6-11(7-9)12(15)14(3)10(2)8-13/h4-7,10H,8,13H2,1-3H3
InChIKeyUASBCFDUIJNRPU-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.41
Rot. Bonds3

About N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide

N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide (PubChem CID 82507196) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-N,3-dimethylbenzamide
PubChem CID82507196
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-(1-aminopropan-2-yl)-N,3-dimethylbenzamide
SMILESCc1cccc(C(=O)N(C)C(C)CN)c1
InChIInChI=1S/C12H18N2O/c1-9-5-4-6-11(7-9)12(15)14(3)10(2)8-13/h4-7,10H,8,13H2,1-3H3
InChIKeyUASBCFDUIJNRPU-UHFFFAOYSA-N
XLogP1.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide 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-N-(1-aminopropan-2-yl)-3-N-methylbenzene-1,3-dicarboxamide
CID 119584009
N,3-dimethyl-N-propan-2-ylbenzamide
CID 91322011
N-(1-aminopropan-2-yl)-N,3,4-trimethylbenzamide;hydrochloride
CID 119584915
N-(1-aminopropan-2-yl)-3-hydroxy-N,4-dimethylbenzamide
CID 104556594
N-(1-aminopropan-2-yl)-3-fluoro-N,5-dimethylbenzamide;hydrochloride
CID 86780016
N-(1-aminopropan-2-yl)-3-chloro-N,4-dimethylbenzamide
CID 119583428
N-(1-aminopropan-2-yl)-4-(dimethylamino)-N-methylbenzamide
CID 104556646
N-(1-aminopropan-2-yl)-3,4-dimethoxy-N-methylbenzamide
CID 112701397
N-(1-aminopropan-2-yl)-N-methyl-3-phenylmethoxybenzamide;hydrochloride
CID 119583865
N-(1-aminopropan-2-yl)-N,2,5-trimethyl-1-(3-methylphenyl)pyrrole-3-carboxamide
CID 119583884
N-(1-aminopropan-2-yl)-3,4-dimethoxy-N-methylbenzamide;hydrochloride
CID 119583303
1-N-(1-aminopropan-2-yl)-4-N,4-N-diethyl-1-N-methylbenzene-1,4-dicarboxamide
CID 119584199

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide?
The IUPAC name of N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide (CID 82507196) is N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide is Cc1cccc(C(=O)N(C)C(C)CN)c1.
What is the InChIKey of N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide?
The InChIKey is UASBCFDUIJNRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-5-4-6-11(7-9)12(15)14(3)10(2)8-13/h4-7,10H,8,13H2,1-3H3.
What are the key properties of N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide?
N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide has a molecular weight of 206.29 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-N,3-dimethylbenzamide is sourced from PubChem (CID 82507196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).