N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine

C14H28N2 — CID 61449433

IUPACN-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine
SMILESCCC1CCC(N(C)CCNC2CC2)CC1
InChIInChI=1S/C14H28N2/c1-3-12-4-8-14(9-5-12)16(2)11-10-15-13-6-7-13/h12-15H,3-11H2,1-2H3
InChIKeyBIXUHWZAHLIRBI-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds6

About N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine

N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine (PubChem CID 61449433) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine
PubChem CID61449433
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine
SMILESCCC1CCC(N(C)CCNC2CC2)CC1
InChIInChI=1S/C14H28N2/c1-3-12-4-8-14(9-5-12)16(2)11-10-15-13-6-7-13/h12-15H,3-11H2,1-2H3
InChIKeyBIXUHWZAHLIRBI-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,1-dioxothiolan-3-yl)-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine
CID 62558264
N'-cyclopentyl-N'-methyl-N-(4-propylcyclohexyl)ethane-1,2-diamine
CID 63462451
N'-cyclohexyl-N-(4-ethylcycloheptyl)-N'-methylpropane-1,3-diamine
CID 65083055
N,N'-dicyclopentyl-N'-methylethane-1,2-diamine
CID 60850716
N'-(4-ethylcyclohexyl)-N,N'-dimethylbutane-1,4-diamine
CID 61449335
4-N-methyl-4-N-octyl-1-N-propylcyclohexane-1,4-diamine
CID 79122187
N-cyclopropyl-2,2-diethyl-N'-(4-ethylcyclohexyl)-N'-methylpropane-1,3-diamine
CID 63494314
N-butyl-4-ethyl-N-methylcyclohexan-1-amine;ethane
CID 155582825
N'-(4-ethylcyclohexyl)-N-(4-fluorophenyl)-N'-methylethane-1,2-diamine
CID 63504348
3-[(4-ethylcyclohexyl)-methylamino]propanenitrile
CID 61450909
N'-cyclopropyl-N'-methyl-N-(thiolan-3-yl)ethane-1,2-diamine
CID 62975333
N-cyclopropyl-N'-methyl-N'-(3-methylcyclohexyl)ethane-1,2-diamine
CID 61447072

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine (CID 61449433) is N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine is CCC1CCC(N(C)CCNC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine?
The InChIKey is BIXUHWZAHLIRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-12-4-8-14(9-5-12)16(2)11-10-15-13-6-7-13/h12-15H,3-11H2,1-2H3.
What are the key properties of N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine?
N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 61449433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).