(5-butyl-4-methoxy-2-pyridinyl)methanol

C11H17NO2 — CID 13154061

IUPAC(5-butyl-4-methoxy-2-pyridinyl)methanol
SMILESCCCCc1cnc(CO)cc1OC
InChIInChI=1S/C11H17NO2/c1-3-4-5-9-7-12-10(8-13)6-11(9)14-2/h6-7,13H,3-5,8H2,1-2H3
InChIKeyPDEUKZHFTFQDNX-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.93
Rot. Bonds5

About (5-butyl-4-methoxy-2-pyridinyl)methanol

(5-butyl-4-methoxy-2-pyridinyl)methanol (PubChem CID 13154061) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is (5-butyl-4-methoxy-2-pyridinyl)methanol.

Molecular Properties

Compound Name(5-butyl-4-methoxy-2-pyridinyl)methanol
PubChem CID13154061
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name(5-butyl-4-methoxy-2-pyridinyl)methanol
SMILESCCCCc1cnc(CO)cc1OC
InChIInChI=1S/C11H17NO2/c1-3-4-5-9-7-12-10(8-13)6-11(9)14-2/h6-7,13H,3-5,8H2,1-2H3
InChIKeyPDEUKZHFTFQDNX-UHFFFAOYSA-N
XLogP1.93
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-butyl-4-nitro-2-pyridinyl)methanol
CID 13154058
(5-butyl-4-methoxy-2-pyridinyl)-phenylmethanol
CID 54398419
[5-methoxy-4-(3-phenylpropoxy)-2-pyridinyl]methanol
CID 21221229
(5-methoxy-4-phenyl-2-pyridinyl)methanol
CID 131570308
4-methoxy-5-propyl-2-(trifluoromethyl)pyridine
CID 146203675
(4-butyl-3-methoxyphenyl)-methoxymethanol
CID 143067809
(4-chloro-5-ethyl-2-pyridinyl)methanol
CID 119082270
1-butyl-4-methoxy-2,5-dimethylbenzene
CID 142173395
(4,5-dimethyl-2-pyridinyl)methanol
CID 14296060
[4-methoxy-6-(trifluoromethyl)-3-pyridinyl]methanol
CID 118827482
5-butyl-4-methoxypyrimidin-2-amine
CID 13301093
3-(2,5-dimethoxy-4-pentylphenyl)propan-1-amine
CID 176899183

Frequently Asked Questions

What is the IUPAC name of (5-butyl-4-methoxy-2-pyridinyl)methanol?
The IUPAC name of (5-butyl-4-methoxy-2-pyridinyl)methanol (CID 13154061) is (5-butyl-4-methoxy-2-pyridinyl)methanol.
What is the SMILES notation for (5-butyl-4-methoxy-2-pyridinyl)methanol?
The canonical SMILES for (5-butyl-4-methoxy-2-pyridinyl)methanol is CCCCc1cnc(CO)cc1OC.
What is the InChIKey of (5-butyl-4-methoxy-2-pyridinyl)methanol?
The InChIKey is PDEUKZHFTFQDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-3-4-5-9-7-12-10(8-13)6-11(9)14-2/h6-7,13H,3-5,8H2,1-2H3.
What are the key properties of (5-butyl-4-methoxy-2-pyridinyl)methanol?
(5-butyl-4-methoxy-2-pyridinyl)methanol has a molecular weight of 195.26 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-butyl-4-methoxy-2-pyridinyl)methanol is sourced from PubChem (CID 13154061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).