1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine

C16H31NO — CID 103559437

IUPAC1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
SMILESCCC1CCC(C(CC2(OC)CCC2)NC)CC1
InChIInChI=1S/C16H31NO/c1-4-13-6-8-14(9-7-13)15(17-2)12-16(18-3)10-5-11-16/h13-15,17H,4-12H2,1-3H3
InChIKeyYQLRVHLERRGMKI-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.75
Rot. Bonds6

About 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine

1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine (PubChem CID 103559437) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
PubChem CID103559437
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
SMILESCCC1CCC(C(CC2(OC)CCC2)NC)CC1
InChIInChI=1S/C16H31NO/c1-4-13-6-8-14(9-7-13)15(17-2)12-16(18-3)10-5-11-16/h13-15,17H,4-12H2,1-3H3
InChIKeyYQLRVHLERRGMKI-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559423
N-[1-cyclobutyl-2-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 103559916
1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559654
1-(4-ethylcyclohexyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770174
[1-(2-ethylcyclohexyl)-2-(1-methoxycyclobutyl)ethyl]hydrazine
CID 103560462
1-(4-ethylcyclohexyl)-N,N',N'-trimethylpropane-1,3-diamine
CID 115346285
1-(4-ethylcyclohexyl)-N-methylpent-4-yn-1-amine
CID 65393747
1-(4-ethylcyclohexyl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103035720
1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
CID 116767881
1-(4-ethyl-1-methoxycyclohexyl)-N-methylmethanamine
CID 62108178
[2-cyclopentyl-1-(4-ethylcyclohexyl)ethyl]hydrazine
CID 105231394
1-(4-ethylcyclohexyl)-N-methyl-2-propan-2-ylsulfanylethanamine
CID 65132236

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine?
The IUPAC name of 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine (CID 103559437) is 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine?
The canonical SMILES for 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine is CCC1CCC(C(CC2(OC)CCC2)NC)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine?
The InChIKey is YQLRVHLERRGMKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-4-13-6-8-14(9-7-13)15(17-2)12-16(18-3)10-5-11-16/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine?
1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine has a molecular weight of 253.43 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine is sourced from PubChem (CID 103559437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).