N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine

C19H31N — CID 64776051

IUPACN-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine
SMILESCCNC(Cc1cccc(C)c1)C1CCC(CC)CC1
InChIInChI=1S/C19H31N/c1-4-16-9-11-18(12-10-16)19(20-5-2)14-17-8-6-7-15(3)13-17/h6-8,13,16,18-20H,4-5,9-12,14H2,1-3H3
InChIKeyURWKZIFNDGUYJN-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.73
Rot. Bonds6

About N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine

N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine (PubChem CID 64776051) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine
PubChem CID64776051
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC NameN-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine
SMILESCCNC(Cc1cccc(C)c1)C1CCC(CC)CC1
InChIInChI=1S/C19H31N/c1-4-16-9-11-18(12-10-16)19(20-5-2)14-17-8-6-7-15(3)13-17/h6-8,13,16,18-20H,4-5,9-12,14H2,1-3H3
InChIKeyURWKZIFNDGUYJN-UHFFFAOYSA-N
XLogP4.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-1-(3-ethylcyclopentyl)-2-(3-methylphenyl)ethanamine
CID 65409853
2-(3-chlorophenyl)-N-ethyl-1-(4-ethylcyclohexyl)ethanamine
CID 64776038
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-3-ylethanamine
CID 64776867
N-ethyl-1-(3-ethylcyclopentyl)-2-phenylethanamine
CID 65412003
N-ethyl-1-(4-ethylcyclohexyl)-2-pyridin-4-ylethanamine
CID 64774213
2-(3-chloro-4-fluorophenyl)-N-ethyl-1-(4-ethylcyclohexyl)ethanamine
CID 103040129
N-ethyl-1-(5-methyloxolan-3-yl)-2-(3-methylphenyl)ethanamine
CID 114825892
N-[(4-ethylcyclohexyl)-(3-methylphenyl)methyl]ethanamine
CID 64774201
2-(3,5-dimethylphenyl)-1-(4-ethylcyclohexyl)-N-methylethanamine
CID 64774421
1-(2,2-dimethylcyclohexyl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 107179603
N-ethyl-1-(4-ethylcyclohexyl)-4-phenylbutan-1-amine
CID 65394984
1-(1,4-dithian-2-yl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 79971420

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine (CID 64776051) is N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine is CCNC(Cc1cccc(C)c1)C1CCC(CC)CC1.
What is the InChIKey of N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine?
The InChIKey is URWKZIFNDGUYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-4-16-9-11-18(12-10-16)19(20-5-2)14-17-8-6-7-15(3)13-17/h6-8,13,16,18-20H,4-5,9-12,14H2,1-3H3.
What are the key properties of N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine?
N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine has a molecular weight of 273.46 g/mol, XLogP of 4.73, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-ethylcyclohexyl)-2-(3-methylphenyl)ethanamine is sourced from PubChem (CID 64776051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).