3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline

C19H32N2 — CID 105151275

IUPAC3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline
SMILESCCNC(c1cccc(N(C)C)c1)C1CCCCC1CC
InChIInChI=1S/C19H32N2/c1-5-15-10-7-8-13-18(15)19(20-6-2)16-11-9-12-17(14-16)21(3)4/h9,11-12,14-15,18-20H,5-8,10,13H2,1-4H3
InChIKeyCPJRHVXRNFRYRY-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.62
Rot. Bonds6

About 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline

3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline (PubChem CID 105151275) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline
PubChem CID105151275
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline
SMILESCCNC(c1cccc(N(C)C)c1)C1CCCCC1CC
InChIInChI=1S/C19H32N2/c1-5-15-10-7-8-13-18(15)19(20-6-2)16-11-9-12-17(14-16)21(3)4/h9,11-12,14-15,18-20H,5-8,10,13H2,1-4H3
InChIKeyCPJRHVXRNFRYRY-UHFFFAOYSA-N
XLogP4.62
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[cycloheptyl(propylamino)methyl]-N,N-dimethylaniline
CID 105176253
N-[(2-ethylcyclohexyl)-(3-fluorophenyl)methyl]propan-1-amine
CID 63861829
3-[2-cyclopropyl-1-(ethylamino)ethyl]-N,N-dimethylaniline
CID 105152936
N-[(2-chlorophenyl)-(2-ethylcyclohexyl)methyl]ethanamine
CID 63863652
N-[(2-ethylcyclohexyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65195450
N-[1-benzofuran-2-yl-(2-ethylcyclohexyl)methyl]ethanamine
CID 63863656
3-[1-(ethylamino)butyl]-N,N-dimethylaniline
CID 105080535
N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
CID 60818890
N-ethyl-1-(2-ethylcyclohexyl)-2-phenylbutan-1-amine
CID 115862425
N-[(2-ethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105151189
3-[ethylamino-(4-methylphenyl)methyl]-N,N-dimethylaniline
CID 105092548
3-[2-cyclopropyl-1-(methylamino)ethyl]-N,N-dimethylaniline
CID 105152827

Frequently Asked Questions

What is the IUPAC name of 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline?
The IUPAC name of 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline (CID 105151275) is 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline.
What is the SMILES notation for 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline?
The canonical SMILES for 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline is CCNC(c1cccc(N(C)C)c1)C1CCCCC1CC.
What is the InChIKey of 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline?
The InChIKey is CPJRHVXRNFRYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-15-10-7-8-13-18(15)19(20-6-2)16-11-9-12-17(14-16)21(3)4/h9,11-12,14-15,18-20H,5-8,10,13H2,1-4H3.
What are the key properties of 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline?
3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline has a molecular weight of 288.48 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethylamino-(2-ethylcyclohexyl)methyl]-N,N-dimethylaniline is sourced from PubChem (CID 105151275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).