[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol

C13H26N2O — CID 106359738

IUPAC[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol
SMILESOCC1CCCCC1NCC1CCCNC1
InChIInChI=1S/C13H26N2O/c16-10-12-5-1-2-6-13(12)15-9-11-4-3-7-14-8-11/h11-16H,1-10H2
InChIKeyKANBCOSQXZIPDO-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.13
Rot. Bonds4

About [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol

[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol (PubChem CID 106359738) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol
PubChem CID106359738
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol
SMILESOCC1CCCCC1NCC1CCCNC1
InChIInChI=1S/C13H26N2O/c16-10-12-5-1-2-6-13(12)15-9-11-4-3-7-14-8-11/h11-16H,1-10H2
InChIKeyKANBCOSQXZIPDO-UHFFFAOYSA-N
XLogP1.13
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(piperidin-3-ylmethylamino)cyclopentyl]methanol
CID 106359502
2-methyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 80553082
N-[2-(hydroxymethyl)cyclopentyl]-2-piperidin-3-ylacetamide
CID 114178697
N-(piperidin-3-ylmethyl)cyclododecanamine
CID 83958102
[2-(oxan-4-ylmethylamino)cyclohexyl]methanol
CID 115685723
piperidin-3-ylmethanol
CID 161361606
2-methoxy-N-(piperidin-3-ylmethyl)cyclopentan-1-amine
CID 62086661
N-(piperidin-3-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 80554243
N-(piperidin-3-ylmethyl)pyrrolidin-2-amine
CID 105440865
[2-[(1-methylpiperidin-3-yl)methylamino]cyclopentyl]methanol
CID 106359457
N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 86317945
N-[2-(hydroxymethyl)cyclohexyl]-3-pyrrolidin-3-ylpropanamide
CID 114178713

Frequently Asked Questions

What is the IUPAC name of [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol?
The IUPAC name of [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol (CID 106359738) is [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol.
What is the SMILES notation for [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol?
The canonical SMILES for [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol is OCC1CCCCC1NCC1CCCNC1.
What is the InChIKey of [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol?
The InChIKey is KANBCOSQXZIPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c16-10-12-5-1-2-6-13(12)15-9-11-4-3-7-14-8-11/h11-16H,1-10H2.
What are the key properties of [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol?
[2-(piperidin-3-ylmethylamino)cyclohexyl]methanol has a molecular weight of 226.36 g/mol, XLogP of 1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(piperidin-3-ylmethylamino)cyclohexyl]methanol is sourced from PubChem (CID 106359738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).