1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine

C18H35N — CID 65390042

IUPAC1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
SMILESCNC(C1CCC(C)(C)CC1)C1CCC(C)C(C)C1
InChIInChI=1S/C18H35N/c1-13-6-7-16(12-14(13)2)17(19-5)15-8-10-18(3,4)11-9-15/h13-17,19H,6-12H2,1-5H3
InChIKeyJHFBJRYRDSAQOK-UHFFFAOYSA-N
MW265.49 g/mol
LogP4.86
Rot. Bonds3

About 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine

1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine (PubChem CID 65390042) has the molecular formula C18H35N and a molecular weight of 265.49 g/mol. Its IUPAC name is 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
PubChem CID65390042
Molecular FormulaC18H35N
Molecular Weight265.49 g/mol
Exact Mass265.28
IUPAC Name1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine
SMILESCNC(C1CCC(C)(C)CC1)C1CCC(C)C(C)C1
InChIInChI=1S/C18H35N/c1-13-6-7-16(12-14(13)2)17(19-5)15-8-10-18(3,4)11-9-15/h13-17,19H,6-12H2,1-5H3
InChIKeyJHFBJRYRDSAQOK-UHFFFAOYSA-N
XLogP4.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.49
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine (CID 65390042) is 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine is CNC(C1CCC(C)(C)CC1)C1CCC(C)C(C)C1.
What is the InChIKey of 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
The InChIKey is JHFBJRYRDSAQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-13-6-7-16(12-14(13)2)17(19-5)15-8-10-18(3,4)11-9-15/h13-17,19H,6-12H2,1-5H3.
What are the key properties of 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine?
1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine has a molecular weight of 265.49 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylcyclohexyl)-1-(4,4-dimethylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 65390042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).