3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide

C16H24N2O2 — CID 115362491

IUPAC3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCC2(CO)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-18(2)14-7-5-6-13(10-14)15(20)17-11-16(12-19)8-3-4-9-16/h5-7,10,19H,3-4,8-9,11-12H2,1-2H3,(H,17,20)
InChIKeyHVGAPRDIWLGYBR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds5

About 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide

3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide (PubChem CID 115362491) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
PubChem CID115362491
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCC2(CO)CCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-18(2)14-7-5-6-13(10-14)15(20)17-11-16(12-19)8-3-4-9-16/h5-7,10,19H,3-4,8-9,11-12H2,1-2H3,(H,17,20)
InChIKeyHVGAPRDIWLGYBR-UHFFFAOYSA-N
XLogP2.04
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-N-[[1-(dimethylamino)cyclohexyl]methyl]benzamide
CID 2108139
3-(dimethylamino)-N-[(1-hydroxycycloheptyl)methyl]benzamide
CID 65123540
3-(dimethylamino)-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 24564777
1-[[[3-(dimethylamino)benzoyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 115445284
3-(dimethylamino)-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzamide
CID 107301705
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-3-pyrrol-1-ylbenzamide
CID 80716345
3-hydroxy-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-4-methylbenzamide
CID 115993853
3-(dimethylamino)-N-[1-(hydroxymethyl)-4-methylcyclohexyl]benzamide
CID 62525606
3-(dimethylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 30604269
3-(dimethylamino)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107231911
4-[[3-(dimethylamino)benzoyl]amino]butanoic acid
CID 43089726
4-fluoro-N-[[1-(hydroxymethyl)cyclohexyl]methyl]-3-methylbenzamide
CID 115701270

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide (CID 115362491) is 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide is CN(C)c1cccc(C(=O)NCC2(CO)CCCC2)c1.
What is the InChIKey of 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide?
The InChIKey is HVGAPRDIWLGYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18(2)14-7-5-6-13(10-14)15(20)17-11-16(12-19)8-3-4-9-16/h5-7,10,19H,3-4,8-9,11-12H2,1-2H3,(H,17,20).
What are the key properties of 3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide?
3-(dimethylamino)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.04, 5 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)cyclopentyl]methyl]benzamide is sourced from PubChem (CID 115362491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).