[4-(N,4-dimethylanilino)quinolin-2-yl]methanol

C18H18N2O — CID 63375751

IUPAC[4-(N,4-dimethylanilino)quinolin-2-yl]methanol
SMILESCc1ccc(N(C)c2cc(CO)nc3ccccc23)cc1
InChIInChI=1S/C18H18N2O/c1-13-7-9-15(10-8-13)20(2)18-11-14(12-21)19-17-6-4-3-5-16(17)18/h3-11,21H,12H2,1-2H3
InChIKeyDUPAKTGPBGXMPX-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.80
Rot. Bonds3

About [4-(N,4-dimethylanilino)quinolin-2-yl]methanol

[4-(N,4-dimethylanilino)quinolin-2-yl]methanol (PubChem CID 63375751) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is [4-(N,4-dimethylanilino)quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-(N,4-dimethylanilino)quinolin-2-yl]methanol
PubChem CID63375751
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name[4-(N,4-dimethylanilino)quinolin-2-yl]methanol
SMILESCc1ccc(N(C)c2cc(CO)nc3ccccc23)cc1
InChIInChI=1S/C18H18N2O/c1-13-7-9-15(10-8-13)20(2)18-11-14(12-21)19-17-6-4-3-5-16(17)18/h3-11,21H,12H2,1-2H3
InChIKeyDUPAKTGPBGXMPX-UHFFFAOYSA-N
XLogP3.80
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(N-ethylanilino)quinolin-2-yl]methanol
CID 63376096
[4-[2-methoxyethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376401
[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
CID 63375970
[4-[3,3-dimethylbutan-2-yl(methyl)amino]quinolin-2-yl]methanol
CID 63376235
[4-[propan-2-yl(propyl)amino]quinolin-2-yl]methanol
CID 63376398
2-(aminomethyl)-N-methyl-N-(2-methylphenyl)quinolin-4-amine
CID 63377115
1-[[[2-(hydroxymethyl)quinolin-4-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114952352
[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol
CID 63375839
[4-[pentyl(propan-2-yl)amino]quinolin-2-yl]methanol
CID 63445535
[4-[furan-3-ylmethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376321
[4-(3-methylphenoxy)quinolin-2-yl]methanol
CID 63376019
[4-[butyl(cyclopropyl)amino]quinolin-2-yl]methanol
CID 63375838

Frequently Asked Questions

What is the IUPAC name of [4-(N,4-dimethylanilino)quinolin-2-yl]methanol?
The IUPAC name of [4-(N,4-dimethylanilino)quinolin-2-yl]methanol (CID 63375751) is [4-(N,4-dimethylanilino)quinolin-2-yl]methanol.
What is the SMILES notation for [4-(N,4-dimethylanilino)quinolin-2-yl]methanol?
The canonical SMILES for [4-(N,4-dimethylanilino)quinolin-2-yl]methanol is Cc1ccc(N(C)c2cc(CO)nc3ccccc23)cc1.
What is the InChIKey of [4-(N,4-dimethylanilino)quinolin-2-yl]methanol?
The InChIKey is DUPAKTGPBGXMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-7-9-15(10-8-13)20(2)18-11-14(12-21)19-17-6-4-3-5-16(17)18/h3-11,21H,12H2,1-2H3.
What are the key properties of [4-(N,4-dimethylanilino)quinolin-2-yl]methanol?
[4-(N,4-dimethylanilino)quinolin-2-yl]methanol has a molecular weight of 278.36 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(N,4-dimethylanilino)quinolin-2-yl]methanol is sourced from PubChem (CID 63375751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).