[2-(pyridin-2-ylamino)cyclohexyl]methanol

C12H18N2O — CID 106362177

IUPAC[2-(pyridin-2-ylamino)cyclohexyl]methanol
SMILESOCC1CCCCC1Nc1ccccn1
InChIInChI=1S/C12H18N2O/c15-9-10-5-1-2-6-11(10)14-12-7-3-4-8-13-12/h3-4,7-8,10-11,15H,1-2,5-6,9H2,(H,13,14)
InChIKeyQTRDXJKXYDPDQK-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.04
Rot. Bonds3

About [2-(pyridin-2-ylamino)cyclohexyl]methanol

[2-(pyridin-2-ylamino)cyclohexyl]methanol (PubChem CID 106362177) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [2-(pyridin-2-ylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[2-(pyridin-2-ylamino)cyclohexyl]methanol
PubChem CID106362177
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[2-(pyridin-2-ylamino)cyclohexyl]methanol
SMILESOCC1CCCCC1Nc1ccccn1
InChIInChI=1S/C12H18N2O/c15-9-10-5-1-2-6-11(10)14-12-7-3-4-8-13-12/h3-4,7-8,10-11,15H,1-2,5-6,9H2,(H,13,14)
InChIKeyQTRDXJKXYDPDQK-UHFFFAOYSA-N
XLogP2.04
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(pyridin-2-ylamino)cyclohexyl]methanol?
The IUPAC name of [2-(pyridin-2-ylamino)cyclohexyl]methanol (CID 106362177) is [2-(pyridin-2-ylamino)cyclohexyl]methanol.
What is the SMILES notation for [2-(pyridin-2-ylamino)cyclohexyl]methanol?
The canonical SMILES for [2-(pyridin-2-ylamino)cyclohexyl]methanol is OCC1CCCCC1Nc1ccccn1.
What is the InChIKey of [2-(pyridin-2-ylamino)cyclohexyl]methanol?
The InChIKey is QTRDXJKXYDPDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c15-9-10-5-1-2-6-11(10)14-12-7-3-4-8-13-12/h3-4,7-8,10-11,15H,1-2,5-6,9H2,(H,13,14).
What are the key properties of [2-(pyridin-2-ylamino)cyclohexyl]methanol?
[2-(pyridin-2-ylamino)cyclohexyl]methanol has a molecular weight of 206.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(pyridin-2-ylamino)cyclohexyl]methanol is sourced from PubChem (CID 106362177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).