4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide

C16H24N2O2 — CID 43393996

IUPAC4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
SMILESCN(C)Cc1ccc(C(=O)NC2CCC(O)CC2)cc1
InChIInChI=1S/C16H24N2O2/c1-18(2)11-12-3-5-13(6-4-12)16(20)17-14-7-9-15(19)10-8-14/h3-6,14-15,19H,7-11H2,1-2H3,(H,17,20)
InChIKeyURUPEUGJGSYYFI-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.78
Rot. Bonds4

About 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide

4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide (PubChem CID 43393996) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
PubChem CID43393996
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
SMILESCN(C)Cc1ccc(C(=O)NC2CCC(O)CC2)cc1
InChIInChI=1S/C16H24N2O2/c1-18(2)11-12-3-5-13(6-4-12)16(20)17-14-7-9-15(19)10-8-14/h3-6,14-15,19H,7-11H2,1-2H3,(H,17,20)
InChIKeyURUPEUGJGSYYFI-UHFFFAOYSA-N
XLogP1.78
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(dimethylamino)methyl]-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 104957519
N-cyclopropyl-3-[4-[[4-[(dimethylamino)methyl]phenyl]methylcarbamoyl]phenyl]-4-methylbenzamide
CID 91394925
N-cyclopropyl-4-[[cyclopropyl(propanoyl)amino]methyl]benzamide
CID 33341018
N-(4-hydroxycyclohexyl)-4-[(3-methylbut-2-enoylamino)methyl]benzamide
CID 111470046
4-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389222
4-[[benzenesulfonyl(methyl)amino]methyl]-N-cyclopropylbenzamide
CID 95933789
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N,2,3-trimethylbenzamide
CID 38398694
N-cyclopropyl-4-[[1H-imidazol-5-ylmethyl(methyl)amino]methyl]benzamide
CID 166193454
4-[[4-[(dimethylamino)methyl]benzoyl]amino]cyclopent-2-ene-1-carboxylic acid
CID 79192506
N-cyclopropyl-4-[[[(2R)-2-hydroxy-2-phenylacetyl]-methylamino]methyl]benzamide
CID 86781611
4-benzyl-N-cyclopropylbenzamide
CID 45086871
4-(chloromethyl)-N-(4-methylcyclohexyl)benzamide
CID 43333286

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide?
The IUPAC name of 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide (CID 43393996) is 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide.
What is the SMILES notation for 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide?
The canonical SMILES for 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide is CN(C)Cc1ccc(C(=O)NC2CCC(O)CC2)cc1.
What is the InChIKey of 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide?
The InChIKey is URUPEUGJGSYYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18(2)11-12-3-5-13(6-4-12)16(20)17-14-7-9-15(19)10-8-14/h3-6,14-15,19H,7-11H2,1-2H3,(H,17,20).
What are the key properties of 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide?
4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide has a molecular weight of 276.38 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide is sourced from PubChem (CID 43393996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).