N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine

C18H30N2O — CID 43180403

IUPACN-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine
SMILESCCOc1ccccc1C(CN)N(CC)C1CCCCC1
InChIInChI=1S/C18H30N2O/c1-3-20(15-10-6-5-7-11-15)17(14-19)16-12-8-9-13-18(16)21-4-2/h8-9,12-13,15,17H,3-7,10-11,14,19H2,1-2H3
InChIKeyUDXXRGZZGBLCNH-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.74
Rot. Bonds7

About N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine

N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine (PubChem CID 43180403) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine
PubChem CID43180403
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine
SMILESCCOc1ccccc1C(CN)N(CC)C1CCCCC1
InChIInChI=1S/C18H30N2O/c1-3-20(15-10-6-5-7-11-15)17(14-19)16-12-8-9-13-18(16)21-4-2/h8-9,12-13,15,17H,3-7,10-11,14,19H2,1-2H3
InChIKeyUDXXRGZZGBLCNH-UHFFFAOYSA-N
XLogP3.74
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-1-[2-(difluoromethoxy)phenyl]-N-ethylethane-1,2-diamine
CID 43540885
N-cyclopropyl-1-(2-ethoxyphenyl)-N-propylethane-1,2-diamine
CID 43270179
N-cyclopropyl-1-(2-ethoxyphenyl)-N-methylethane-1,2-diamine
CID 43264757
N-(1-cyclopropylethyl)-1-(2-ethoxyphenyl)-N-methylethane-1,2-diamine
CID 43568904
N'-cyclopentyl-1-(2-ethoxyphenyl)-N'-methylethane-1,2-diamine
CID 43267133
N-cyclohexyl-1-(2,6-difluorophenyl)-N-ethylethane-1,2-diamine
CID 43180409
1-(2-ethoxyphenyl)-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
CID 61433486
2-[1-[cyclohexyl(ethyl)amino]propyl]phenol
CID 82974115
1-(2-ethoxyphenyl)-N-ethyl-N-phenylethane-1,2-diamine
CID 43180434
N-cyclohexyl-N-ethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 43078748
N-cyclohexyl-N-ethyl-1-(3-methoxyphenyl)ethane-1,2-diamine
CID 16783431
1-(2-ethoxyphenyl)-N-methyl-N-pentan-3-ylethane-1,2-diamine
CID 43570790

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine?
The IUPAC name of N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine (CID 43180403) is N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine.
What is the SMILES notation for N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine?
The canonical SMILES for N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine is CCOc1ccccc1C(CN)N(CC)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine?
The InChIKey is UDXXRGZZGBLCNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-3-20(15-10-6-5-7-11-15)17(14-19)16-12-8-9-13-18(16)21-4-2/h8-9,12-13,15,17H,3-7,10-11,14,19H2,1-2H3.
What are the key properties of N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine?
N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine has a molecular weight of 290.45 g/mol, XLogP of 3.74, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(2-ethoxyphenyl)-N-ethylethane-1,2-diamine is sourced from PubChem (CID 43180403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).