1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine

C18H35N — CID 65394157

IUPAC1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(C(NC)C2CCCC(CC)C2)CC1
InChIInChI=1S/C18H35N/c1-4-14-9-11-16(12-10-14)18(19-3)17-8-6-7-15(5-2)13-17/h14-19H,4-13H2,1-3H3
InChIKeyATMBGGWDNWGUGT-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.01
Rot. Bonds5

About 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine

1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine (PubChem CID 65394157) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
PubChem CID65394157
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(C(NC)C2CCCC(CC)C2)CC1
InChIInChI=1S/C18H35N/c1-4-14-9-11-16(12-10-14)18(19-3)17-8-6-7-15(5-2)13-17/h14-19H,4-13H2,1-3H3
InChIKeyATMBGGWDNWGUGT-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclohexyl)methanamine
CID 64774419
1-(3-ethylcyclohexyl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 65422358
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclopentyl)methanamine
CID 65413158
1-(2,2-dimethylcyclopropyl)-1-(3-ethylcyclohexyl)-N-methylmethanamine
CID 107004575
1-(3-ethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65330302
1-(4-ethylcyclohexyl)-N-methyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105155375
1-(2-ethylcyclohexyl)-1-(3-ethylcyclopentyl)-N-methylmethanamine
CID 65409841
1-(3-ethylcyclopentyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65410427
1-(4-ethylcyclohexyl)-N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 104990951
1-(4-ethylcycloheptyl)-2-methylpropan-1-amine
CID 79298507
[(3-ethylcyclopentyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105233577
N-[cyclobutyl-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 64986298

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine (CID 65394157) is 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine is CCC1CCC(C(NC)C2CCCC(CC)C2)CC1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine?
The InChIKey is ATMBGGWDNWGUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-4-14-9-11-16(12-10-14)18(19-3)17-8-6-7-15(5-2)13-17/h14-19H,4-13H2,1-3H3.
What are the key properties of 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine?
1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine has a molecular weight of 265.48 g/mol, XLogP of 5.01, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 65394157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).