N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide

C17H26N2O — CID 45001445

IUPACN-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide
SMILESCN(C)C(CNC(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15/h3,5-6,9-10,15-16H,4,7-8,11-13H2,1-2H3,(H,18,20)
InChIKeyOPPJHUGODJAQFZ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.99
Rot. Bonds5

About N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide

N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide (PubChem CID 45001445) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide
PubChem CID45001445
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide
SMILESCN(C)C(CNC(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15/h3,5-6,9-10,15-16H,4,7-8,11-13H2,1-2H3,(H,18,20)
InChIKeyOPPJHUGODJAQFZ-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(dimethylamino)-2-phenylethyl]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

3-amino-N-[2-(dimethylamino)-2-phenylethyl]cyclohexane-1-carboxamide
CID 63046098
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]cyclohexanecarboxamide
CID 46529103
N-[(2R)-2-(diethylamino)-2-phenylethyl]cyclobutanecarboxamide
CID 51922888
3-amino-N-[2-(dimethylamino)-2-phenylethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119828747
(1S)-N-[(2R)-2-(dimethylamino)-2-phenylethyl]cyclohex-3-ene-1-carboxamide
CID 32730513
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]cyclohexanecarboxamide
CID 17447079
(1R)-N-[(2S)-2-(dimethylamino)-2-phenylethyl]cyclohex-3-ene-1-carboxamide
CID 32730507
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]cyclopentanecarboxamide
CID 43020482
N-(2-bromo-2-phenylethyl)cyclohexanecarboxamide
CID 113274135
N-[(2S)-2-hydroxy-2-phenylethyl]cyclopentanecarboxamide
CID 93032915
N-[(2S)-2-phenylbutyl]cyclobutanecarboxamide
CID 39952483
N-[2-(dimethylamino)-2-phenylethyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 51153656

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide (CID 45001445) is N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide is CN(C)C(CNC(=O)C1CCCCC1)c1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide?
The InChIKey is OPPJHUGODJAQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-19(2)16(14-9-5-3-6-10-14)13-18-17(20)15-11-7-4-8-12-15/h3,5-6,9-10,15-16H,4,7-8,11-13H2,1-2H3,(H,18,20).
What are the key properties of N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide?
N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide has a molecular weight of 274.41 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-phenylethyl]cyclohexanecarboxamide is sourced from PubChem (CID 45001445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).