1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine

C14H30N2 — CID 43181504

IUPAC1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCC1CCCC(C)C1NCC(C)(C)N(C)C
InChIInChI=1S/C14H30N2/c1-11-8-7-9-12(2)13(11)15-10-14(3,4)16(5)6/h11-13,15H,7-10H2,1-6H3
InChIKeySIILGQGCEYLFNR-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.74
Rot. Bonds4

About 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine

1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine (PubChem CID 43181504) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
PubChem CID43181504
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCC1CCCC(C)C1NCC(C)(C)N(C)C
InChIInChI=1S/C14H30N2/c1-11-8-7-9-12(2)13(11)15-10-14(3,4)16(5)6/h11-13,15H,7-10H2,1-6H3
InChIKeySIILGQGCEYLFNR-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,2-N,2-trimethyl-1-N-[3-(trifluoromethyl)cyclohexyl]propane-1,2-diamine
CID 64756963
2-N,2-N,2-trimethyl-1-N-(thian-4-yl)propane-1,2-diamine
CID 43394916
2-N,2-N,2-trimethyl-1-N-piperidin-4-ylpropane-1,2-diamine
CID 61015538
N-(cyclopentylmethyl)-2,6-dimethylcyclohexan-1-amine
CID 43370923
N,N,2,2-tetramethyl-N'-[(1R,2S)-2-methylcyclopentyl]propane-1,3-diamine
CID 96923102
2-N,2-N,2-trimethyl-1-N-(1-propan-2-ylpiperidin-4-yl)propane-1,2-diamine
CID 28651810
N-(2,3-dimethylbutyl)-2,6-dimethylcyclohexan-1-amine
CID 64569259
2-N,2-N,2-trimethyl-1-N-(2-phenylcyclohexyl)propane-1,2-diamine
CID 43767796
3-[(2,6-dimethylcyclohexyl)amino]-1,1,1-trifluoropropan-2-ol
CID 115712116
2,6-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclohexan-1-amine
CID 115724485
1-N-(6-bicyclo[3.2.0]hept-3-enyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 43223906
N-but-3-enyl-2,6-dimethylcyclohexan-1-amine
CID 104577567

Frequently Asked Questions

What is the IUPAC name of 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The IUPAC name of 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine (CID 43181504) is 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine is CC1CCCC(C)C1NCC(C)(C)N(C)C.
What is the InChIKey of 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
The InChIKey is SIILGQGCEYLFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-11-8-7-9-12(2)13(11)15-10-14(3,4)16(5)6/h11-13,15H,7-10H2,1-6H3.
What are the key properties of 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine?
1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2,6-dimethylcyclohexyl)-2-N,2-N,2-trimethylpropane-1,2-diamine is sourced from PubChem (CID 43181504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).