2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine

C16H34N2 — CID 43409655

IUPAC2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
SMILESCCN(C1CCCCC1)C(C)(CN)CCC(C)C
InChIInChI=1S/C16H34N2/c1-5-18(15-9-7-6-8-10-15)16(4,13-17)12-11-14(2)3/h14-15H,5-13,17H2,1-4H3
InChIKeyBHHUGZWPUOXRGC-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.79
Rot. Bonds7

About 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine

2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine (PubChem CID 43409655) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
PubChem CID43409655
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
SMILESCCN(C1CCCCC1)C(C)(CN)CCC(C)C
InChIInChI=1S/C16H34N2/c1-5-18(15-9-7-6-8-10-15)16(4,13-17)12-11-14(2)3/h14-15H,5-13,17H2,1-4H3
InChIKeyBHHUGZWPUOXRGC-UHFFFAOYSA-N
XLogP3.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-cyclopentyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 43540970
2-N-cyclopropyl-2,5-dimethyl-2-N-(3-methylbutyl)hexane-1,2-diamine
CID 78974063
2-N-cyclopentyl-2-N,2,5-trimethylhexane-1,2-diamine
CID 43267042
2-N-cyclohexyl-3-ethoxy-2-N-ethyl-2-methylpropane-1,2-diamine
CID 113493169
2-N-cyclopentyl-2-N-ethyl-3-methoxy-2-methylpropane-1,2-diamine
CID 62535108
2-N-(cyclopropylmethyl)-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 63956765
2-N-cyclopropyl-2-methyl-2-N-(3-methylbutyl)heptane-1,2-diamine
CID 80558361
2-N-cyclopropyl-2-methyl-2-N-(2-methylpropyl)nonane-1,2-diamine
CID 63465034
2-N-cyclopropyl-2-methyl-2-N-(3-methylbutyl)nonane-1,2-diamine
CID 78944020
2-N-butan-2-yl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine
CID 43274363
2-N-cyclopropyl-2-methyl-2-N-(3-methylbutyl)-4-phenylbutane-1,2-diamine
CID 78973586
2-N-cyclopentyl-2-N-ethyl-2-methyl-3-phenylpropane-1,2-diamine
CID 55150298

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine?
The IUPAC name of 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine (CID 43409655) is 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine.
What is the SMILES notation for 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine?
The canonical SMILES for 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine is CCN(C1CCCCC1)C(C)(CN)CCC(C)C.
What is the InChIKey of 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine?
The InChIKey is BHHUGZWPUOXRGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-5-18(15-9-7-6-8-10-15)16(4,13-17)12-11-14(2)3/h14-15H,5-13,17H2,1-4H3.
What are the key properties of 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine?
2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine has a molecular weight of 254.46 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclohexyl-2-N-ethyl-2,5-dimethylhexane-1,2-diamine is sourced from PubChem (CID 43409655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).