[1-(quinolin-2-ylamino)cyclohexyl]methanol

C16H20N2O — CID 62521521

IUPAC[1-(quinolin-2-ylamino)cyclohexyl]methanol
SMILESOCC1(Nc2ccc3ccccc3n2)CCCCC1
InChIInChI=1S/C16H20N2O/c19-12-16(10-4-1-5-11-16)18-15-9-8-13-6-2-3-7-14(13)17-15/h2-3,6-9,19H,1,4-5,10-12H2,(H,17,18)
InChIKeyCDCGTNCGNJCCIY-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.34
Rot. Bonds3

About [1-(quinolin-2-ylamino)cyclohexyl]methanol

[1-(quinolin-2-ylamino)cyclohexyl]methanol (PubChem CID 62521521) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is [1-(quinolin-2-ylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(quinolin-2-ylamino)cyclohexyl]methanol
PubChem CID62521521
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name[1-(quinolin-2-ylamino)cyclohexyl]methanol
SMILESOCC1(Nc2ccc3ccccc3n2)CCCCC1
InChIInChI=1S/C16H20N2O/c19-12-16(10-4-1-5-11-16)18-15-9-8-13-6-2-3-7-14(13)17-15/h2-3,6-9,19H,1,4-5,10-12H2,(H,17,18)
InChIKeyCDCGTNCGNJCCIY-UHFFFAOYSA-N
XLogP3.34
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(quinolin-2-ylamino)cyclohexyl]methanol?
The IUPAC name of [1-(quinolin-2-ylamino)cyclohexyl]methanol (CID 62521521) is [1-(quinolin-2-ylamino)cyclohexyl]methanol.
What is the SMILES notation for [1-(quinolin-2-ylamino)cyclohexyl]methanol?
The canonical SMILES for [1-(quinolin-2-ylamino)cyclohexyl]methanol is OCC1(Nc2ccc3ccccc3n2)CCCCC1.
What is the InChIKey of [1-(quinolin-2-ylamino)cyclohexyl]methanol?
The InChIKey is CDCGTNCGNJCCIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c19-12-16(10-4-1-5-11-16)18-15-9-8-13-6-2-3-7-14(13)17-15/h2-3,6-9,19H,1,4-5,10-12H2,(H,17,18).
What are the key properties of [1-(quinolin-2-ylamino)cyclohexyl]methanol?
[1-(quinolin-2-ylamino)cyclohexyl]methanol has a molecular weight of 256.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(quinolin-2-ylamino)cyclohexyl]methanol is sourced from PubChem (CID 62521521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).