N,N-dimethyl-3-(2-methylpropyl)benzamide

C13H19NO — CID 59462491

IUPACN,N-dimethyl-3-(2-methylpropyl)benzamide
SMILESCC(C)Cc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C13H19NO/c1-10(2)8-11-6-5-7-12(9-11)13(15)14(3)4/h5-7,9-10H,8H2,1-4H3
InChIKeyAITKARIKFMTRDG-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.59
Rot. Bonds3

About N,N-dimethyl-3-(2-methylpropyl)benzamide

N,N-dimethyl-3-(2-methylpropyl)benzamide (PubChem CID 59462491) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N,N-dimethyl-3-(2-methylpropyl)benzamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(2-methylpropyl)benzamide
PubChem CID59462491
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN,N-dimethyl-3-(2-methylpropyl)benzamide
SMILESCC(C)Cc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C13H19NO/c1-10(2)8-11-6-5-7-12(9-11)13(15)14(3)4/h5-7,9-10H,8H2,1-4H3
InChIKeyAITKARIKFMTRDG-UHFFFAOYSA-N
XLogP2.59
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethyl-3-(2-methylpropyl)benzenecarbothioamide
CID 23333039
N,N-dimethyl-3-(propan-2-yloxymethyl)benzamide
CID 140929179
3-(2-methylpropyl)benzamide
CID 23130390
(2S)-2-[methyl-[3-(2-methylpropyl)benzoyl]amino]butanedioic acid
CID 90059112
N,3-bis(2-methylpropyl)benzamide
CID 176945198
N-[2-[bis[2-[methyl-[3-(2-methylpropyl)benzoyl]amino]ethyl]amino]ethyl]-N-methyl-3-propylbenzamide
CID 155097548
N,N-dimethyl-3-(methylaminomethyl)benzamide
CID 83814364
fluoro 3-(2-methylpropyl)benzoate
CID 176661814
3-[[[(2R)-2-aminopropanoyl]amino]methyl]-N,N-dimethylbenzamide;hydrochloride
CID 119287449
(2,6-difluorophenyl)-[3-(2-methylpropyl)phenyl]methanone
CID 116543370
(E)-1-[3-(2-methylpropyl)phenyl]but-2-en-1-one
CID 103453516
3-(2-amino-2-sulfanylideneethyl)-N,N-dimethylbenzamide
CID 82179287

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(2-methylpropyl)benzamide?
The IUPAC name of N,N-dimethyl-3-(2-methylpropyl)benzamide (CID 59462491) is N,N-dimethyl-3-(2-methylpropyl)benzamide.
What is the SMILES notation for N,N-dimethyl-3-(2-methylpropyl)benzamide?
The canonical SMILES for N,N-dimethyl-3-(2-methylpropyl)benzamide is CC(C)Cc1cccc(C(=O)N(C)C)c1.
What is the InChIKey of N,N-dimethyl-3-(2-methylpropyl)benzamide?
The InChIKey is AITKARIKFMTRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(2)8-11-6-5-7-12(9-11)13(15)14(3)4/h5-7,9-10H,8H2,1-4H3.
What are the key properties of N,N-dimethyl-3-(2-methylpropyl)benzamide?
N,N-dimethyl-3-(2-methylpropyl)benzamide has a molecular weight of 205.30 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2-methylpropyl)benzamide is sourced from PubChem (CID 59462491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).