N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine

C18H35N — CID 112682231

IUPACN-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESCC1(C)CCCC(NC2CC(C)(C)CC(C)(C)C2)C1
InChIInChI=1S/C18H35N/c1-16(2)9-7-8-14(10-16)19-15-11-17(3,4)13-18(5,6)12-15/h14-15,19H,7-13H2,1-6H3
InChIKeyMUHGXOLPQDZWSD-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.15
Rot. Bonds2

About N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine

N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine (PubChem CID 112682231) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine
PubChem CID112682231
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC NameN-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine
SMILESCC1(C)CCCC(NC2CC(C)(C)CC(C)(C)C2)C1
InChIInChI=1S/C18H35N/c1-16(2)9-7-8-14(10-16)19-15-11-17(3,4)13-18(5,6)12-15/h14-15,19H,7-13H2,1-6H3
InChIKeyMUHGXOLPQDZWSD-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1,3,3,5,5-pentamethylcyclohexan-1-amine
CID 10130369
3-methyl-N-(3-methylcyclohexyl)cyclohexan-1-amine
CID 20454197
1,3,3-Trimethyl-N-(2-methylpropyl)-5-((2-methylpropyl)amino)cyclohexanemethanamine
CID 54504755
Di(3,3,5-trimethylcyclohexyl)amine
CID 237388
1-cyclohexyl-N-(2-cyclohexylethyl)pentan-2-amine
CID 172458077
N-cyclohexyl-4,4-dimethylcyclohexan-1-amine
CID 64415665
N-(2,4-dimethylcyclohexyl)-2,4-dimethylcyclohexan-1-amine
CID 64762914
3,3,5-trimethyl-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 43434417
3,3,5-trimethyl-N-[2-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 43434505
3,3,5-trimethyl-N-[4-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 43434633
2,4,4-trimethyl-N-[3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 81321114
N-(3-fluoropropyl)-3,3-dimethylcyclohexan-1-amine
CID 81422951

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The IUPAC name of N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine (CID 112682231) is N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine.
What is the SMILES notation for N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The canonical SMILES for N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine is CC1(C)CCCC(NC2CC(C)(C)CC(C)(C)C2)C1.
What is the InChIKey of N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
The InChIKey is MUHGXOLPQDZWSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-16(2)9-7-8-14(10-16)19-15-11-17(3,4)13-18(5,6)12-15/h14-15,19H,7-13H2,1-6H3.
What are the key properties of N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine?
N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine has a molecular weight of 265.48 g/mol, XLogP of 5.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclohexyl)-3,3,5,5-tetramethylcyclohexan-1-amine is sourced from PubChem (CID 112682231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).