(1-methoxycycloheptyl)-quinolin-3-ylmethanol

C18H23NO2 — CID 116755913

IUPAC(1-methoxycycloheptyl)-quinolin-3-ylmethanol
SMILESCOC1(C(O)c2cnc3ccccc3c2)CCCCCC1
InChIInChI=1S/C18H23NO2/c1-21-18(10-6-2-3-7-11-18)17(20)15-12-14-8-4-5-9-16(14)19-13-15/h4-5,8-9,12-13,17,20H,2-3,6-7,10-11H2,1H3
InChIKeyPMAARQWWWXTLNT-UHFFFAOYSA-N
MW285.39 g/mol
LogP4.01
Rot. Bonds3

About (1-methoxycycloheptyl)-quinolin-3-ylmethanol

(1-methoxycycloheptyl)-quinolin-3-ylmethanol (PubChem CID 116755913) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is (1-methoxycycloheptyl)-quinolin-3-ylmethanol.

Molecular Properties

Compound Name(1-methoxycycloheptyl)-quinolin-3-ylmethanol
PubChem CID116755913
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name(1-methoxycycloheptyl)-quinolin-3-ylmethanol
SMILESCOC1(C(O)c2cnc3ccccc3c2)CCCCCC1
InChIInChI=1S/C18H23NO2/c1-21-18(10-6-2-3-7-11-18)17(20)15-12-14-8-4-5-9-16(14)19-13-15/h4-5,8-9,12-13,17,20H,2-3,6-7,10-11H2,1H3
InChIKeyPMAARQWWWXTLNT-UHFFFAOYSA-N
XLogP4.01
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-methoxycycloheptyl)-quinolin-3-ylmethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[hydroxy(quinolin-3-yl)methyl]cycloheptan-1-ol
CID 103452070
(2-methyloxan-2-yl)-quinolin-3-ylmethanol
CID 80684863
(1-methoxycyclohexyl)-phenylmethanol
CID 116753267
1-(1-ethoxycyclopentyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 116761853
(1-methoxycyclopentyl)-(5-methyl-3-pyridinyl)methanol
CID 104610441
(1-methoxycyclopentyl)-quinolin-6-ylmethanamine
CID 104610565
(5-fluoro-3-pyridinyl)-(1-methoxycyclopentyl)methanol
CID 104610410
fluoro(quinolin-3-yl)methanol
CID 163892772
(5-methylpyrazin-2-yl)-quinolin-3-ylmethanol
CID 105079360
[(1-methylcyclopentyl)-quinolin-3-ylmethyl]hydrazine
CID 105286886
2,2-dimethyl-1-quinolin-3-ylpropan-1-ol
CID 60924299
(1-methoxycyclobutyl)-(5-methyl-3-pyridinyl)methanol
CID 116710441

Frequently Asked Questions

What is the IUPAC name of (1-methoxycycloheptyl)-quinolin-3-ylmethanol?
The IUPAC name of (1-methoxycycloheptyl)-quinolin-3-ylmethanol (CID 116755913) is (1-methoxycycloheptyl)-quinolin-3-ylmethanol.
What is the SMILES notation for (1-methoxycycloheptyl)-quinolin-3-ylmethanol?
The canonical SMILES for (1-methoxycycloheptyl)-quinolin-3-ylmethanol is COC1(C(O)c2cnc3ccccc3c2)CCCCCC1.
What is the InChIKey of (1-methoxycycloheptyl)-quinolin-3-ylmethanol?
The InChIKey is PMAARQWWWXTLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-21-18(10-6-2-3-7-11-18)17(20)15-12-14-8-4-5-9-16(14)19-13-15/h4-5,8-9,12-13,17,20H,2-3,6-7,10-11H2,1H3.
What are the key properties of (1-methoxycycloheptyl)-quinolin-3-ylmethanol?
(1-methoxycycloheptyl)-quinolin-3-ylmethanol has a molecular weight of 285.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycycloheptyl)-quinolin-3-ylmethanol is sourced from PubChem (CID 116755913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).