3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide

C18H34N2O — CID 103917226

IUPAC3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C18H34N2O/c1-18(2,17(21)19-3)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,20H,4-13H2,1-3H3,(H,19,21)
InChIKeyRHUWYLOEJRIBKI-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.49
Rot. Bonds5

About 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide

3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide (PubChem CID 103917226) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide.

Molecular Properties

Compound Name3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide
PubChem CID103917226
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C18H34N2O/c1-18(2,17(21)19-3)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,20H,4-13H2,1-3H3,(H,19,21)
InChIKeyRHUWYLOEJRIBKI-UHFFFAOYSA-N
XLogP3.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
CID 63452484
N-(2-cyclohexylcyclohexyl)-N',N',2,2-tetramethylpropane-1,3-diamine
CID 43223114
2-[[(2-cyclopropylcyclohexyl)amino]methyl]-2-ethylbutanoic acid
CID 122128693
N,2,2-trimethyl-3-[(3-methylcyclobutyl)amino]propanamide
CID 104859958
N,2,2-trimethyl-3-(thiolan-3-ylamino)propanamide
CID 104530421
N,2,2-trimethyl-3-[(1-methylpyrrolidin-3-yl)amino]propanamide
CID 103824204
N-[2-[(2-cyclohexylcyclohexyl)amino]ethyl]-2-methylpropanamide
CID 43223719
2-cyclohexyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 43222835
(2R)-1-[(2-cyclohexylcyclohexyl)amino]propan-2-ol
CID 113349396
2-cyclohexyl-N-(3-methylbut-2-enyl)cyclohexan-1-amine
CID 106180008
3-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-ylamino)-N,2,2-trimethylpropanamide
CID 103917229
N-(cyclodecylmethyl)-2-cycloundecylcyclohexan-1-amine
CID 146209039

Frequently Asked Questions

What is the IUPAC name of 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide?
The IUPAC name of 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide (CID 103917226) is 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide.
What is the SMILES notation for 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide?
The canonical SMILES for 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide is CNC(=O)C(C)(C)CNC1CCCCC1C1CCCCC1.
What is the InChIKey of 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide?
The InChIKey is RHUWYLOEJRIBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-18(2,17(21)19-3)13-20-16-12-8-7-11-15(16)14-9-5-4-6-10-14/h14-16,20H,4-13H2,1-3H3,(H,19,21).
What are the key properties of 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide?
3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide has a molecular weight of 294.48 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-cyclohexylcyclohexyl)amino]-N,2,2-trimethylpropanamide is sourced from PubChem (CID 103917226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).