3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide

C17H26N2O2 — CID 62525606

IUPAC3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
SMILESCC1CCC(CO)(NC(=O)c2cccc(N(C)C)c2)CC1
InChIInChI=1S/C17H26N2O2/c1-13-7-9-17(12-20,10-8-13)18-16(21)14-5-4-6-15(11-14)19(2)3/h4-6,11,13,20H,7-10,12H2,1-3H3,(H,18,21)
InChIKeyUZDMARRBZXBDSY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.42
Rot. Bonds4

About 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide

3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide (PubChem CID 62525606) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
PubChem CID62525606
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
SMILESCC1CCC(CO)(NC(=O)c2cccc(N(C)C)c2)CC1
InChIInChI=1S/C17H26N2O2/c1-13-7-9-17(12-20,10-8-13)18-16(21)14-5-4-6-15(11-14)19(2)3/h4-6,11,13,20H,7-10,12H2,1-3H3,(H,18,21)
InChIKeyUZDMARRBZXBDSY-UHFFFAOYSA-N
XLogP2.42
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62527858
4-acetyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 86791516
3-bromo-N-[1-(hydroxymethyl)-4-methylcyclohexyl]-4-methylbenzamide
CID 81471727
4-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62527504
3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
CID 115362491
2-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62526979
1-N-[1-(hydroxymethyl)cyclopentyl]-3-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 110008531
N-(2-cyclopropyl-2-hydroxy-2-phenylethyl)-3-(dimethylamino)benzamide
CID 71788754
3-chloro-N-[1-(hydroxymethyl)-4-methylcyclohexyl]-2-methylbenzamide
CID 107097755
phenyl N-[1-(hydroxymethyl)-4-methylcyclohexyl]carbamate
CID 62526000
N-[1-(hydroxymethyl)-4-methylcyclohexyl]-2,5-dimethylfuran-3-carboxamide
CID 62526454
2-[[3-(dimethylamino)benzoyl]amino]cyclopentane-1-carboxylic acid
CID 64814509

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide (CID 62525606) is 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide is CC1CCC(CO)(NC(=O)c2cccc(N(C)C)c2)CC1.
What is the InChIKey of 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide?
The InChIKey is UZDMARRBZXBDSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-7-9-17(12-20,10-8-13)18-16(21)14-5-4-6-15(11-14)19(2)3/h4-6,11,13,20H,7-10,12H2,1-3H3,(H,18,21).
What are the key properties of 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide?
3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide has a molecular weight of 290.41 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide is sourced from PubChem (CID 62525606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).