N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine

C15H30N2 — CID 55089114

IUPACN-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine
SMILESCC1CCCCC1N(C)CCNC(C)C1CC1
InChIInChI=1S/C15H30N2/c1-12-6-4-5-7-15(12)17(3)11-10-16-13(2)14-8-9-14/h12-16H,4-11H2,1-3H3
InChIKeyDPCFXMJNDWLWIW-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds6

About N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine

N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine (PubChem CID 55089114) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine
PubChem CID55089114
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine
SMILESCC1CCCCC1N(C)CCNC(C)C1CC1
InChIInChI=1S/C15H30N2/c1-12-6-4-5-7-15(12)17(3)11-10-16-13(2)14-8-9-14/h12-16H,4-11H2,1-3H3
InChIKeyDPCFXMJNDWLWIW-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The IUPAC name of N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine (CID 55089114) is N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The canonical SMILES for N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine is CC1CCCCC1N(C)CCNC(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The InChIKey is DPCFXMJNDWLWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12-6-4-5-7-15(12)17(3)11-10-16-13(2)14-8-9-14/h12-16H,4-11H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N'-methyl-N'-(2-methylcyclohexyl)ethane-1,2-diamine is sourced from PubChem (CID 55089114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).