[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol

C18H24N2O — CID 63375839

IUPAC[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol
SMILESCN(CC1CCCCC1)c1cc(CO)nc2ccccc12
InChIInChI=1S/C18H24N2O/c1-20(12-14-7-3-2-4-8-14)18-11-15(13-21)19-17-10-6-5-9-16(17)18/h5-6,9-11,14,21H,2-4,7-8,12-13H2,1H3
InChIKeyVSOUHZVAAYBLOQ-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.74
Rot. Bonds4

About [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol

[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol (PubChem CID 63375839) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol
PubChem CID63375839
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol
SMILESCN(CC1CCCCC1)c1cc(CO)nc2ccccc12
InChIInChI=1S/C18H24N2O/c1-20(12-14-7-3-2-4-8-14)18-11-15(13-21)19-17-10-6-5-9-16(17)18/h5-6,9-11,14,21H,2-4,7-8,12-13H2,1H3
InChIKeyVSOUHZVAAYBLOQ-UHFFFAOYSA-N
XLogP3.74
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol
CID 79311164
[2-[cyclopentylmethyl(methyl)amino]quinolin-4-yl]methanol
CID 63631449
1-[[[2-(hydroxymethyl)quinolin-4-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114952352
1-[4-[[(2-ethylquinolin-4-yl)-methylamino]methyl]piperidin-1-yl]propan-2-ol
CID 133401409
[4-[2-methoxyethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376401
[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
CID 63375970
2-[4-[[(2-ethylquinolin-4-yl)-methylamino]methyl]piperidin-1-yl]-N-methylacetamide
CID 133402186
[4-[butyl(cyclopropyl)amino]quinolin-2-yl]methanol
CID 63375838
[4-[furan-3-ylmethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376321
[4-(N,4-dimethylanilino)quinolin-2-yl]methanol
CID 63375751
[4-(N-ethylanilino)quinolin-2-yl]methanol
CID 63376096
[4-[3,3-dimethylbutan-2-yl(methyl)amino]quinolin-2-yl]methanol
CID 63376235

Frequently Asked Questions

What is the IUPAC name of [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol?
The IUPAC name of [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol (CID 63375839) is [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol.
What is the SMILES notation for [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol?
The canonical SMILES for [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol is CN(CC1CCCCC1)c1cc(CO)nc2ccccc12.
What is the InChIKey of [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol?
The InChIKey is VSOUHZVAAYBLOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-20(12-14-7-3-2-4-8-14)18-11-15(13-21)19-17-10-6-5-9-16(17)18/h5-6,9-11,14,21H,2-4,7-8,12-13H2,1H3.
What are the key properties of [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol?
[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol has a molecular weight of 284.40 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol is sourced from PubChem (CID 63375839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).