1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine

C18H29N — CID 63413394

IUPAC1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
SMILESCNC(Cc1ccc(C(C)C)cc1)C1CCCCC1
InChIInChI=1S/C18H29N/c1-14(2)16-11-9-15(10-12-16)13-18(19-3)17-7-5-4-6-8-17/h9-12,14,17-19H,4-8,13H2,1-3H3
InChIKeyIUNJXENRUUENFB-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.52
Rot. Bonds5

About 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine

1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine (PubChem CID 63413394) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
PubChem CID63413394
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
SMILESCNC(Cc1ccc(C(C)C)cc1)C1CCCCC1
InChIInChI=1S/C18H29N/c1-14(2)16-11-9-15(10-12-16)13-18(19-3)17-7-5-4-6-8-17/h9-12,14,17-19H,4-8,13H2,1-3H3
InChIKeyIUNJXENRUUENFB-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-cyclooctyl-2-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105254967
1-cycloheptyl-2-(4-fluorophenyl)-N-methylethanamine
CID 55091488
N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 107188350
1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine
CID 54980091
1-cyclohexyl-2-(4-propan-2-ylphenyl)ethanol
CID 63410841
2-cyclopentyl-N-methyl-3-(4-propan-2-ylphenyl)propan-1-amine
CID 112569760
1-(2,2-dimethylcyclopentyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107188347
1-cyclopentyl-N-methyl-2-(4-propan-2-ylphenyl)sulfanylethanamine
CID 104755248
1-(2,2-dimethylcyclopropyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107004322
N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
CID 82262639
2-cyclopentyl-N-propan-2-yl-3-(4-propan-2-ylphenyl)propan-1-amine
CID 115926698
(1S)-1-cycloheptyl-N-[(4-propan-2-ylphenyl)methyl]ethanamine
CID 81390306

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine (CID 63413394) is 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine is CNC(Cc1ccc(C(C)C)cc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is IUNJXENRUUENFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-14(2)16-11-9-15(10-12-16)13-18(19-3)17-7-5-4-6-8-17/h9-12,14,17-19H,4-8,13H2,1-3H3.
What are the key properties of 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine?
1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 259.44 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 63413394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).