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

C18H35NO — CID 116767881

IUPAC1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(C(NC)C2(OC)CCCC(C)C2)CC1
InChIInChI=1S/C18H35NO/c1-5-15-8-10-16(11-9-15)17(19-3)18(20-4)12-6-7-14(2)13-18/h14-17,19H,5-13H2,1-4H3
InChIKeyVJIPHHAAYWKVIH-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.39
Rot. Bonds5

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

1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine (PubChem CID 116767881) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
PubChem CID116767881
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
SMILESCCC1CCC(C(NC)C2(OC)CCCC(C)C2)CC1
InChIInChI=1S/C18H35NO/c1-5-15-8-10-16(11-9-15)17(19-3)18(20-4)12-6-7-14(2)13-18/h14-17,19H,5-13H2,1-4H3
InChIKeyVJIPHHAAYWKVIH-UHFFFAOYSA-N
XLogP4.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylcyclohexyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770174
2-cyclopropyl-1-(1-methoxy-3-methylcyclohexyl)-N-methylethanamine
CID 116767760
1-(1-ethoxy-4-methylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 116767209
N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine
CID 116770366
1-(1-methoxy-3-methylcyclohexyl)-N,2-dimethylpropan-1-amine
CID 116767848
1-(1-methoxy-3-methylcyclohexyl)-N,2-dimethylprop-2-en-1-amine
CID 116767764
1-(1-methoxy-3-methylcyclohexyl)-N-methylbut-3-yn-1-amine
CID 116767850
1-(1-ethoxycycloheptyl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 116770863
1-(1-methoxy-3-methylcyclohexyl)-N-methylbut-3-en-1-amine
CID 116767736
2-(4-ethylphenyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylethanamine
CID 116767869
1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 104610994
2-cyclopropyl-1-(1-ethoxy-3-methylcyclohexyl)ethanamine
CID 116767988

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine (CID 116767881) is 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine is CCC1CCC(C(NC)C2(OC)CCCC(C)C2)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine?
The InChIKey is VJIPHHAAYWKVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-5-15-8-10-16(11-9-15)17(19-3)18(20-4)12-6-7-14(2)13-18/h14-17,19H,5-13H2,1-4H3.
What are the key properties of 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine?
1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine has a molecular weight of 281.48 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 116767881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).