3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide

C16H24N2O — CID 115916570

IUPAC3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide
SMILESCNC(=O)c1cccc(NC(C)CC2CCC2)c1C
InChIInChI=1S/C16H24N2O/c1-11(10-13-6-4-7-13)18-15-9-5-8-14(12(15)2)16(19)17-3/h5,8-9,11,13,18H,4,6-7,10H2,1-3H3,(H,17,19)
InChIKeyDJVWUBGRWPAAJD-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.35
Rot. Bonds5

About 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide

3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide (PubChem CID 115916570) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide.

Molecular Properties

Compound Name3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide
PubChem CID115916570
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide
SMILESCNC(=O)c1cccc(NC(C)CC2CCC2)c1C
InChIInChI=1S/C16H24N2O/c1-11(10-13-6-4-7-13)18-15-9-5-8-14(12(15)2)16(19)17-3/h5,8-9,11,13,18H,4,6-7,10H2,1-3H3,(H,17,19)
InChIKeyDJVWUBGRWPAAJD-UHFFFAOYSA-N
XLogP3.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-cyclopropylpropan-2-ylamino)-2-methylbenzamide
CID 115928848
3-(1-cyclopropylethylamino)-N,2-dimethylbenzamide
CID 43734592
3-(1-cyclopropylpropylamino)-N,2-dimethylbenzamide
CID 64918620
N,2-dimethyl-3-[1-(1-methylpiperidin-4-yl)ethylamino]benzamide
CID 43734494
N,2-dimethyl-3-(nonan-2-ylamino)benzamide
CID 43734562
N,2-dimethyl-3-[(1-methylpiperidin-3-yl)methylamino]benzamide
CID 62658463
N-(1-cyclobutylpropan-2-yl)naphthalen-1-amine
CID 113489674
N,2-dimethyl-3-(oxan-3-ylmethylamino)benzamide
CID 63740558
3-[[2-(cyclopentanecarbonylamino)acetyl]amino]-N,2-dimethylbenzamide
CID 46434201
3-[(3-cyclopropylcyclohexyl)amino]-N,2-dimethylbenzamide
CID 64596426
N,2-dimethyl-3-[1-(5-methylfuran-2-yl)ethylamino]benzamide
CID 43734599
3-[(4,4-dimethylcycloheptyl)amino]-N,2-dimethylbenzamide
CID 65083034

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide?
The IUPAC name of 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide (CID 115916570) is 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide.
What is the SMILES notation for 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide?
The canonical SMILES for 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide is CNC(=O)c1cccc(NC(C)CC2CCC2)c1C.
What is the InChIKey of 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide?
The InChIKey is DJVWUBGRWPAAJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11(10-13-6-4-7-13)18-15-9-5-8-14(12(15)2)16(19)17-3/h5,8-9,11,13,18H,4,6-7,10H2,1-3H3,(H,17,19).
What are the key properties of 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide?
3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide has a molecular weight of 260.38 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclobutylpropan-2-ylamino)-N,2-dimethylbenzamide is sourced from PubChem (CID 115916570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).