[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol

C16H32N2O — CID 106360313

IUPAC[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol
SMILESCC1(C)CCC(CN)(NC2CCCCC2CO)CC1
InChIInChI=1S/C16H32N2O/c1-15(2)7-9-16(12-17,10-8-15)18-14-6-4-3-5-13(14)11-19/h13-14,18-19H,3-12,17H2,1-2H3
InChIKeyIOALEKXGYAXZRV-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.42
Rot. Bonds4

About [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol

[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol (PubChem CID 106360313) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol
PubChem CID106360313
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol
SMILESCC1(C)CCC(CN)(NC2CCCCC2CO)CC1
InChIInChI=1S/C16H32N2O/c1-15(2)7-9-16(12-17,10-8-15)18-14-6-4-3-5-13(14)11-19/h13-14,18-19H,3-12,17H2,1-2H3
InChIKeyIOALEKXGYAXZRV-UHFFFAOYSA-N
XLogP2.42
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol with MolForge

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Related Compounds

[2-[[4-(aminomethyl)-1-(2-methylpropyl)piperidin-4-yl]amino]cyclohexyl]methanol
CID 106360413
[2-[[3-(aminomethyl)oxolan-3-yl]amino]cyclohexyl]methanol
CID 106360446
[2-[[4-(aminomethyl)-1-propan-2-ylpiperidin-4-yl]amino]cyclopentyl]methanol
CID 106359944
[2-[[1-(aminomethyl)-3,5-dimethylcyclohexyl]amino]cyclopentyl]methanol
CID 106359954
[2-[[1-(aminomethyl)-3-cyclopropylcyclohexyl]amino]cyclohexyl]methanol
CID 106360376
[2-[[7-(aminomethyl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-yl]amino]cyclopentyl]methanol
CID 106360020
[2-[[1-(aminomethyl)-2-ethylcyclopentyl]amino]cyclohexyl]methanol
CID 114178587
1-(aminomethyl)-N-cyclopentyl-3,3-dimethylcyclopentan-1-amine
CID 80706363
[2-[[3-(aminomethyl)-2-methylthiolan-3-yl]amino]cyclohexyl]methanol
CID 114178599
[2-[[1-(aminomethyl)-2,5-dimethylcyclohexyl]amino]cyclohexyl]methanol
CID 106360359
N-[1-(aminomethyl)-3,3-dimethylcyclobutyl]cyclopentanamine
CID 130847292
[2-[[2-(aminomethyl)cyclopentyl]amino]cyclohexyl]methanol
CID 106359831

Frequently Asked Questions

What is the IUPAC name of [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol?
The IUPAC name of [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol (CID 106360313) is [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol?
The canonical SMILES for [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol is CC1(C)CCC(CN)(NC2CCCCC2CO)CC1.
What is the InChIKey of [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol?
The InChIKey is IOALEKXGYAXZRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-15(2)7-9-16(12-17,10-8-15)18-14-6-4-3-5-13(14)11-19/h13-14,18-19H,3-12,17H2,1-2H3.
What are the key properties of [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol?
[2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol has a molecular weight of 268.44 g/mol, XLogP of 2.42, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[1-(aminomethyl)-4,4-dimethylcyclohexyl]amino]cyclohexyl]methanol is sourced from PubChem (CID 106360313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).