2,2,3,3-tetramethylcyclohexane-1,1-diamine

C10H22N2 — CID 18624315

IUPAC2,2,3,3-tetramethylcyclohexane-1,1-diamine
SMILESCC1(C)CCCC(N)(N)C1(C)C
InChIInChI=1S/C10H22N2/c1-8(2)6-5-7-10(11,12)9(8,3)4/h5-7,11-12H2,1-4H3
InChIKeyQEAAPVKOJNSBKA-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.84
Rot. Bonds

About 2,2,3,3-tetramethylcyclohexane-1,1-diamine

2,2,3,3-tetramethylcyclohexane-1,1-diamine (PubChem CID 18624315) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 2,2,3,3-tetramethylcyclohexane-1,1-diamine.

Molecular Properties

Compound Name2,2,3,3-tetramethylcyclohexane-1,1-diamine
PubChem CID18624315
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name2,2,3,3-tetramethylcyclohexane-1,1-diamine
SMILESCC1(C)CCCC(N)(N)C1(C)C
InChIInChI=1S/C10H22N2/c1-8(2)6-5-7-10(11,12)9(8,3)4/h5-7,11-12H2,1-4H3
InChIKeyQEAAPVKOJNSBKA-UHFFFAOYSA-N
XLogP1.84
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-methylcyclobutan-1-amine;hydrochloride
CID 18332449
1-(1-aminoethyl)-2,2-dimethylcyclopentan-1-amine
CID 146176674
1-iodo-1,2,2-trimethylcyclopentane
CID 70443095
ethane;methane;1,1,2,2-tetramethylcyclohexane
CID 144894499
2,2,3,3-tetramethyl-1-oxidopiperidin-1-ium
CID 91234260
2,2-dichlorocyclopentane-1,1-diamine;platinum
CID 88780620
6,6-dimethyldispiro[4.1.47.35]tetradecane
CID 123325796
1,1-dimethylcyclobutane;vanadium
CID 158712416
1-(cyclohexylmethyl)-2,2-dimethylcyclopentan-1-amine
CID 79856330
1-hexyl-2,2-dimethylcyclopentan-1-amine
CID 79857458
formic acid;1-methylcyclobutan-1-amine;hydrochloride
CID 175593564
(1,2,2-trimethylcyclohexyl)methanediamine
CID 142614010

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethylcyclohexane-1,1-diamine?
The IUPAC name of 2,2,3,3-tetramethylcyclohexane-1,1-diamine (CID 18624315) is 2,2,3,3-tetramethylcyclohexane-1,1-diamine.
What is the SMILES notation for 2,2,3,3-tetramethylcyclohexane-1,1-diamine?
The canonical SMILES for 2,2,3,3-tetramethylcyclohexane-1,1-diamine is CC1(C)CCCC(N)(N)C1(C)C.
What is the InChIKey of 2,2,3,3-tetramethylcyclohexane-1,1-diamine?
The InChIKey is QEAAPVKOJNSBKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-8(2)6-5-7-10(11,12)9(8,3)4/h5-7,11-12H2,1-4H3.
What are the key properties of 2,2,3,3-tetramethylcyclohexane-1,1-diamine?
2,2,3,3-tetramethylcyclohexane-1,1-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.84, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethylcyclohexane-1,1-diamine is sourced from PubChem (CID 18624315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).