(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol

C18H17NO2 — CID 68508380

IUPAC(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol
SMILESCc1c(CO)nc2ccccc2c1OCc1ccccc1
InChIInChI=1S/C18H17NO2/c1-13-17(11-20)19-16-10-6-5-9-15(16)18(13)21-12-14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3
InChIKeyRWADIOXBPYJDJD-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.61
Rot. Bonds4

About (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol

(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol (PubChem CID 68508380) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol.

Molecular Properties

Compound Name(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol
PubChem CID68508380
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol
SMILESCc1c(CO)nc2ccccc2c1OCc1ccccc1
InChIInChI=1S/C18H17NO2/c1-13-17(11-20)19-16-10-6-5-9-15(16)18(13)21-12-14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3
InChIKeyRWADIOXBPYJDJD-UHFFFAOYSA-N
XLogP3.61
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methyl-4-phenylmethoxyquinolin-2-yl)methyl]-1-phenylmethanamine
CID 59526922
3-methyl-4-phenylmethoxy-2-(pyridin-2-yloxymethyl)quinoline
CID 59527387
2-(heptoxymethyl)-3-methyl-4-phenylmethoxyquinoline
CID 59527122
2-methyl-5-[3-[(3-methyl-4-phenylmethoxyquinolin-2-yl)methoxy]phenoxy]pentan-2-ol
CID 59527442
4-[4-[(3-methyl-4-phenylmethoxyquinolin-2-yl)methylamino]butyl]phenol
CID 143781927
3-methyl-2-[4-[(2-methylpropan-2-yl)oxy]butoxymethyl]-4-phenylmethoxyquinoline
CID 59526885
1-[2-[3-[(3-methyl-4-phenylmethoxyquinolin-2-yl)methoxy]phenoxy]ethyl]cyclobutan-1-ol
CID 59527448
(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol
CID 54539942
(3-methyl-4-phenylmethoxyquinolin-2-yl)methyl morpholine-4-carboxylate
CID 59527580
2-[[4-(3-methoxy-3-methylbutoxy)-2-pyridinyl]oxymethyl]-3-methyl-4-phenylmethoxyquinoline
CID 59526863
2-[[1-(cyclopropyloxymethyl)cyclopropyl]methoxymethyl]-3-methyl-4-phenylmethoxyquinoline
CID 59526978
[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol
CID 11324699

Frequently Asked Questions

What is the IUPAC name of (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol?
The IUPAC name of (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol (CID 68508380) is (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol.
What is the SMILES notation for (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol?
The canonical SMILES for (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol is Cc1c(CO)nc2ccccc2c1OCc1ccccc1.
What is the InChIKey of (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol?
The InChIKey is RWADIOXBPYJDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13-17(11-20)19-16-10-6-5-9-15(16)18(13)21-12-14-7-3-2-4-8-14/h2-10,20H,11-12H2,1H3.
What are the key properties of (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol?
(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol has a molecular weight of 279.34 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-4-phenylmethoxyquinolin-2-yl)methanol is sourced from PubChem (CID 68508380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).