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

C15H32N2 — CID 62558034

IUPACN'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine
SMILESCCC(C)(C)NCCN(C)C1CCCCC1C
InChIInChI=1S/C15H32N2/c1-6-15(3,4)16-11-12-17(5)14-10-8-7-9-13(14)2/h13-14,16H,6-12H2,1-5H3
InChIKeyNVXFZWMLGCTKMO-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.28
Rot. Bonds6

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

N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine (PubChem CID 62558034) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine
PubChem CID62558034
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine
SMILESCCC(C)(C)NCCN(C)C1CCCCC1C
InChIInChI=1S/C15H32N2/c1-6-15(3,4)16-11-12-17(5)14-10-8-7-9-13(14)2/h13-14,16H,6-12H2,1-5H3
InChIKeyNVXFZWMLGCTKMO-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The IUPAC name of N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine (CID 62558034) is N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine.
What is the SMILES notation for N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The canonical SMILES for N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine is CCC(C)(C)NCCN(C)C1CCCCC1C.
What is the InChIKey of N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
The InChIKey is NVXFZWMLGCTKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-15(3,4)16-11-12-17(5)14-10-8-7-9-13(14)2/h13-14,16H,6-12H2,1-5H3.
What are the key properties of N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine?
N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-(2-methylbutan-2-yl)-N'-(2-methylcyclohexyl)ethane-1,2-diamine is sourced from PubChem (CID 62558034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).