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

C14H30N2 — CID 63966132

IUPACN-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
SMILESCCC(C)(C)N(C)CCNC1CCCCC1
InChIInChI=1S/C14H30N2/c1-5-14(2,3)16(4)12-11-15-13-9-7-6-8-10-13/h13,15H,5-12H2,1-4H3
InChIKeyYEWALFFESMOPHF-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds6

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

N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine (PubChem CID 63966132) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
PubChem CID63966132
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine
SMILESCCC(C)(C)N(C)CCNC1CCCCC1
InChIInChI=1S/C14H30N2/c1-5-14(2,3)16(4)12-11-15-13-9-7-6-8-10-13/h13,15H,5-12H2,1-4H3
InChIKeyYEWALFFESMOPHF-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclooctyl-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 62634350
N-cyclohexyl-N'-methyl-N'-pentylethane-1,2-diamine
CID 62574766
N,N'-dicyclopentyl-N'-methylethane-1,2-diamine
CID 60850716
N-cyclopentyl-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 60850712
N-cyclohexyl-N'-methyl-N'-(3-methylbutan-2-yl)ethane-1,2-diamine
CID 62575849
N-propylcyclohexanamine;hydrochloride
CID 17370003
azane;N-propylcyclohexanamine
CID 19368218
N',N'-dicyclohexyl-N-cyclopentylethane-1,2-diamine
CID 60851932
N'-cyclohexyl-N-[2-(cyclohexylamino)ethyl]ethane-1,2-diamine
CID 23423562
N'-cycloundecylethane-1,2-diamine
CID 166845791
N-cycloheptyl-N'-(1-methoxypropan-2-yl)-N'-methylethane-1,2-diamine
CID 62573668
N-cyclohexyl-N'-(2-methylpropyl)-N'-pentan-3-ylethane-1,2-diamine
CID 79490778

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The IUPAC name of N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine (CID 63966132) is N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine is CCC(C)(C)N(C)CCNC1CCCCC1.
What is the InChIKey of N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
The InChIKey is YEWALFFESMOPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-14(2,3)16(4)12-11-15-13-9-7-6-8-10-13/h13,15H,5-12H2,1-4H3.
What are the key properties of N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine?
N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-methyl-N'-(2-methylbutan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 63966132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).