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

C14H22N2O — CID 43734491

IUPACN,2-dimethyl-3-(2-methylbutylamino)benzamide
SMILESCCC(C)CNc1cccc(C(=O)NC)c1C
InChIInChI=1S/C14H22N2O/c1-5-10(2)9-16-13-8-6-7-12(11(13)3)14(17)15-4/h6-8,10,16H,5,9H2,1-4H3,(H,15,17)
InChIKeyVMGBAJIFKITRCY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.81
Rot. Bonds5

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

N,2-dimethyl-3-(2-methylbutylamino)benzamide (PubChem CID 43734491) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is N,2-dimethyl-3-(2-methylbutylamino)benzamide.

Molecular Properties

Compound NameN,2-dimethyl-3-(2-methylbutylamino)benzamide
PubChem CID43734491
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC NameN,2-dimethyl-3-(2-methylbutylamino)benzamide
SMILESCCC(C)CNc1cccc(C(=O)NC)c1C
InChIInChI=1S/C14H22N2O/c1-5-10(2)9-16-13-8-6-7-12(11(13)3)14(17)15-4/h6-8,10,16H,5,9H2,1-4H3,(H,15,17)
InChIKeyVMGBAJIFKITRCY-UHFFFAOYSA-N
XLogP2.81
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3-chloro-2-methylpropanoyl)amino]-N,2-dimethylbenzamide
CID 55110621
2-methyl-3-(2-methylpentylamino)benzoic acid
CID 43737198
3-[[(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]carbamoylamino]-N,2-dimethylbenzamide
CID 95239461
3-[(5-ethylfuran-2-yl)methylamino]-N,2-dimethylbenzamide
CID 62345277
3-(1-cyclopropylpropylamino)-N,2-dimethylbenzamide
CID 64918620
3-[[(2R)-2-aminopropanoyl]amino]-N,2-dimethylbenzamide
CID 54996136
3-(4-hydroxypentanoylamino)-N,2-dimethylbenzamide
CID 79204866
N,2-dimethyl-3-(3-methylsulfanylpropylamino)benzamide
CID 43734490
N,2-dimethyl-3-(1-thiophen-2-ylpropylamino)benzamide
CID 43734480
N,2-dimethyl-3-(nonan-2-ylamino)benzamide
CID 43734562
methyl 3-(2-ethylbutylamino)-2-methylbenzoate
CID 43714418
3-[(3-hydroxyphenyl)methylamino]-N,2-dimethylbenzamide
CID 43734564

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-(2-methylbutylamino)benzamide?
The IUPAC name of N,2-dimethyl-3-(2-methylbutylamino)benzamide (CID 43734491) is N,2-dimethyl-3-(2-methylbutylamino)benzamide.
What is the SMILES notation for N,2-dimethyl-3-(2-methylbutylamino)benzamide?
The canonical SMILES for N,2-dimethyl-3-(2-methylbutylamino)benzamide is CCC(C)CNc1cccc(C(=O)NC)c1C.
What is the InChIKey of N,2-dimethyl-3-(2-methylbutylamino)benzamide?
The InChIKey is VMGBAJIFKITRCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-5-10(2)9-16-13-8-6-7-12(11(13)3)14(17)15-4/h6-8,10,16H,5,9H2,1-4H3,(H,15,17).
What are the key properties of N,2-dimethyl-3-(2-methylbutylamino)benzamide?
N,2-dimethyl-3-(2-methylbutylamino)benzamide has a molecular weight of 234.34 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-(2-methylbutylamino)benzamide is sourced from PubChem (CID 43734491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).