[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol

C14H28N2O — CID 79708030

IUPAC[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol
SMILESCC1CCC(CO)(NCC2CCNCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12-2-6-14(11-17,7-3-12)16-10-13-4-8-15-9-5-13/h12-13,15-17H,2-11H2,1H3
InChIKeyBGGQKOFFEDFLCE-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.52
Rot. Bonds4

About [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol

[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol (PubChem CID 79708030) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol
PubChem CID79708030
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol
SMILESCC1CCC(CO)(NCC2CCNCC2)CC1
InChIInChI=1S/C14H28N2O/c1-12-2-6-14(11-17,7-3-12)16-10-13-4-8-15-9-5-13/h12-13,15-17H,2-11H2,1H3
InChIKeyBGGQKOFFEDFLCE-UHFFFAOYSA-N
XLogP1.52
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(cyclopropylmethylamino)-4-ethylcyclohexyl]methanol
CID 61056029
[1-(cyclobutylmethylamino)cyclohexyl]methanol
CID 65459866
[4-methyl-1-(2-propan-2-yloxyethylamino)cyclohexyl]methanol
CID 62552501
1-(cyclopropylmethoxy)-3-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]propan-2-ol
CID 62551135
[1-(heptylamino)-4-methylcyclohexyl]methanol
CID 55086742
[1-[[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]methyl]cyclohexyl]methanol
CID 81419348
[4-methyl-1-(octylamino)cyclohexyl]methanol
CID 63476632
[4-methyl-1-[(4-methylcyclohexyl)amino]cyclohexyl]methanol
CID 62526376
[4-(cyclobutylmethylamino)oxan-4-yl]methanol
CID 103713933
[4-methyl-1-(pyrimidin-2-ylmethylamino)cyclohexyl]methanol
CID 62699370
1,1,1-trifluoro-3-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]propan-2-ol
CID 63900670
[1-[(3,5-dimethylphenyl)methylamino]-4-methylcyclohexyl]methanol
CID 62553320

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol?
The IUPAC name of [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol (CID 79708030) is [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol.
What is the SMILES notation for [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol?
The canonical SMILES for [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol is CC1CCC(CO)(NCC2CCNCC2)CC1.
What is the InChIKey of [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol?
The InChIKey is BGGQKOFFEDFLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12-2-6-14(11-17,7-3-12)16-10-13-4-8-15-9-5-13/h12-13,15-17H,2-11H2,1H3.
What are the key properties of [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol?
[4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol has a molecular weight of 240.39 g/mol, XLogP of 1.52, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(piperidin-4-ylmethylamino)cyclohexyl]methanol is sourced from PubChem (CID 79708030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).