3-cyclohexyl-2-methylbutane-1,3-diamine

C11H24N2 — CID 175124630

IUPAC3-cyclohexyl-2-methylbutane-1,3-diamine
SMILESCC(CN)C(C)(N)C1CCCCC1
InChIInChI=1S/C11H24N2/c1-9(8-12)11(2,13)10-6-4-3-5-7-10/h9-10H,3-8,12-13H2,1-2H3
InChIKeyOYNOVDJHVJTVTA-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.88
Rot. Bonds3

About 3-cyclohexyl-2-methylbutane-1,3-diamine

3-cyclohexyl-2-methylbutane-1,3-diamine (PubChem CID 175124630) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 3-cyclohexyl-2-methylbutane-1,3-diamine.

Molecular Properties

Compound Name3-cyclohexyl-2-methylbutane-1,3-diamine
PubChem CID175124630
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name3-cyclohexyl-2-methylbutane-1,3-diamine
SMILESCC(CN)C(C)(N)C1CCCCC1
InChIInChI=1S/C11H24N2/c1-9(8-12)11(2,13)10-6-4-3-5-7-10/h9-10H,3-8,12-13H2,1-2H3
InChIKeyOYNOVDJHVJTVTA-UHFFFAOYSA-N
XLogP1.88
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-2-methylpropan-1-amine
CID 19776368
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909
3-cyclopropyl-3-fluoro-2-methylbutan-1-amine
CID 105428835
2-cyclohexyl-2-cyclopropylpropan-1-amine
CID 83828448
2,2-dicyclohexylbutane-1,3-diamine
CID 23345386
2,3,4-trimethylpentan-3-ylcyclohexane
CID 140706198
(2S)-1-amino-2-cyclohexylpropan-2-ol
CID 93298138
4-cycloheptyl-4-methylpentan-2-ol
CID 82923694
2-cyclopentylbutan-2-amine
CID 43810238
cyclohexanamine;2-methylpropan-1-amine
CID 22649730
copper;1,1-di(cyclooctyl)ethane-1,2-diamine
CID 118577975
(2S)-2-cycloheptylpropan-1-amine
CID 96634967

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-methylbutane-1,3-diamine?
The IUPAC name of 3-cyclohexyl-2-methylbutane-1,3-diamine (CID 175124630) is 3-cyclohexyl-2-methylbutane-1,3-diamine.
What is the SMILES notation for 3-cyclohexyl-2-methylbutane-1,3-diamine?
The canonical SMILES for 3-cyclohexyl-2-methylbutane-1,3-diamine is CC(CN)C(C)(N)C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-2-methylbutane-1,3-diamine?
The InChIKey is OYNOVDJHVJTVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-9(8-12)11(2,13)10-6-4-3-5-7-10/h9-10H,3-8,12-13H2,1-2H3.
What are the key properties of 3-cyclohexyl-2-methylbutane-1,3-diamine?
3-cyclohexyl-2-methylbutane-1,3-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-methylbutane-1,3-diamine is sourced from PubChem (CID 175124630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).