4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine

C17H33NO — CID 43103283

IUPAC4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine
SMILESCCC(C)(C)C1CCC(NC(C)C2CCCO2)CC1
InChIInChI=1S/C17H33NO/c1-5-17(3,4)14-8-10-15(11-9-14)18-13(2)16-7-6-12-19-16/h13-16,18H,5-12H2,1-4H3
InChIKeySNHMBVHIHMRVQQ-UHFFFAOYSA-N
MW267.46 g/mol
LogP4.14
Rot. Bonds5

About 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine

4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine (PubChem CID 43103283) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine
PubChem CID43103283
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC Name4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine
SMILESCCC(C)(C)C1CCC(NC(C)C2CCCO2)CC1
InChIInChI=1S/C17H33NO/c1-5-17(3,4)14-8-10-15(11-9-14)18-13(2)16-7-6-12-19-16/h13-16,18H,5-12H2,1-4H3
InChIKeySNHMBVHIHMRVQQ-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine 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

4-ethyl-N-{[(2R)-oxolan-2-yl]methyl}cyclohexan-1-amine
CID 40515069
N-[(8-tert-butyl-1-oxaspiro[4.5]decan-2-yl)methyl]cyclohexanamine
CID 14303359
4-tert-butyl-N-[(oxolan-2-yl)methyl]cyclohexan-1-amine
CID 14652957
N-[[4-(4-tert-butylcyclohexyl)oxolan-2-yl]methyl]cyclohexanamine
CID 19864357
(2S,5R)-2-[cyclohexyl(methoxy)methyl]-5-propylpyrrolidine
CID 20648546
N-(8-methoxy-7,7-dimethylnonan-4-yl)cyclohexanamine
CID 67674123
N-[2-(4-tert-butylcyclohexyl)oxyethyl]cyclohexanamine;propane
CID 141773518
1-ethyl-1-propan-2-ylcyclopropane;2-methyl-N-(oxolan-2-ylmethyl)propan-1-amine;propan-2-ylcyclohexane
CID 161914868
4-tert-butyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclohexan-1-amine
CID 177300050
4-methyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 17604570
4-tert-butyl-N-[[(2R)-oxolan-2-yl]methyl]cyclohexan-1-amine
CID 26458392
4-tert-butyl-N-[[(2S)-oxolan-2-yl]methyl]cyclohexan-1-amine
CID 26458394

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine (CID 43103283) is 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine is CCC(C)(C)C1CCC(NC(C)C2CCCO2)CC1.
What is the InChIKey of 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine?
The InChIKey is SNHMBVHIHMRVQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-5-17(3,4)14-8-10-15(11-9-14)18-13(2)16-7-6-12-19-16/h13-16,18H,5-12H2,1-4H3.
What are the key properties of 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine?
4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine has a molecular weight of 267.46 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylbutan-2-yl)-N-[1-(oxolan-2-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 43103283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).