N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide

C19H30N2O — CID 46529103

IUPACN-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide
SMILESCCc1ccc(C(CNC(=O)C2CCCCC2)N(C)C)cc1
InChIInChI=1S/C19H30N2O/c1-4-15-10-12-16(13-11-15)18(21(2)3)14-20-19(22)17-8-6-5-7-9-17/h10-13,17-18H,4-9,14H2,1-3H3,(H,20,22)
InChIKeyOYAQSZVLNNKOOK-UHFFFAOYSA-N
MW302.46 g/mol
LogP3.55
Rot. Bonds6

About N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide

N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide (PubChem CID 46529103) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide
PubChem CID46529103
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC NameN-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide
SMILESCCc1ccc(C(CNC(=O)C2CCCCC2)N(C)C)cc1
InChIInChI=1S/C19H30N2O/c1-4-15-10-12-16(13-11-15)18(21(2)3)14-20-19(22)17-8-6-5-7-9-17/h10-13,17-18H,4-9,14H2,1-3H3,(H,20,22)
InChIKeyOYAQSZVLNNKOOK-UHFFFAOYSA-N
XLogP3.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide
CID 45001445
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]cyclohexanecarboxamide
CID 17447079
tert-butyl 4-[[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]carbamoyl]piperidine-1-carboxylate
CID 39961035
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 55575997
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]cyclopentanecarboxamide
CID 43020482
3-[[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]carbamoylamino]-N-propan-2-ylcyclohexane-1-carboxamide
CID 86962728
1-(2,4-difluorobenzoyl)-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide
CID 24640246
1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-N-[(2S)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]piperidine-4-carboxamide
CID 27798668
N-[(2S)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide
CID 25487612
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-2-pyridin-4-ylazepane-1-carboxamide
CID 112831935
1-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-[[(1S,2S)-2-hydroxycyclopentyl]methyl]urea;hydrochloride
CID 170913337
(3S)-N-[(2R)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-1-propanoylpiperidine-3-carboxamide
CID 94799885

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide (CID 46529103) is N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide is CCc1ccc(C(CNC(=O)C2CCCCC2)N(C)C)cc1.
What is the InChIKey of N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide?
The InChIKey is OYAQSZVLNNKOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c1-4-15-10-12-16(13-11-15)18(21(2)3)14-20-19(22)17-8-6-5-7-9-17/h10-13,17-18H,4-9,14H2,1-3H3,(H,20,22).
What are the key properties of N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide?
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide has a molecular weight of 302.46 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 46529103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).