(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol

C10H11ClN2O — CID 59471428

IUPAC(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol
SMILESCCn1c(CO)cc2ccc(Cl)nc21
InChIInChI=1S/C10H11ClN2O/c1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13/h3-5,14H,2,6H2,1H3
InChIKeyMHCXRAOMNQMFFB-UHFFFAOYSA-N
MW210.66 g/mol
LogP2.20
Rot. Bonds2

About (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol

(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol (PubChem CID 59471428) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol.

Molecular Properties

Compound Name(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol
PubChem CID59471428
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol
SMILESCCn1c(CO)cc2ccc(Cl)nc21
InChIInChI=1S/C10H11ClN2O/c1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13/h3-5,14H,2,6H2,1H3
InChIKeyMHCXRAOMNQMFFB-UHFFFAOYSA-N
XLogP2.20
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

[1-ethyl-6-(trifluoromethyl)indol-2-yl]methanol
CID 117122614
[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane
CID 156829346
[5-(aminomethyl)-1-ethylindol-2-yl]methanol
CID 117177076
[5-chloro-1-(3-methylsulfonylpropyl)pyrrolo[3,2-b]pyridin-2-yl]methanol
CID 118915052
1-(6-chloropyrrolo[2,3-b]pyridin-1-yl)ethanone
CID 141368895
(5-butyl-1-ethylpyrrol-2-yl)methanol
CID 100793109
[1-ethyl-5-(2-methylpropyl)pyrrol-2-yl]methanol
CID 100792639
2-(5-chloro-1-ethylindol-2-yl)ethanol
CID 117121550
7-chloro-1-ethyl-4-oxo-1,8-naphthyridine-3-carbonyl chloride
CID 21434993
7-chloro-1-(2,2-diethoxyethyl)-1,8-naphthyridin-2-one
CID 130302480
methyl 6-chloro-2-methylpyrrolo[2,3-b]pyridine-1-carboxylate
CID 73013581
(3-ethyl-2-methylimidazol-4-yl)methanol
CID 117193179

Frequently Asked Questions

What is the IUPAC name of (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol?
The IUPAC name of (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol (CID 59471428) is (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol.
What is the SMILES notation for (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol?
The canonical SMILES for (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol is CCn1c(CO)cc2ccc(Cl)nc21.
What is the InChIKey of (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol?
The InChIKey is MHCXRAOMNQMFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-2-13-8(6-14)5-7-3-4-9(11)12-10(7)13/h3-5,14H,2,6H2,1H3.
What are the key properties of (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol?
(6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol has a molecular weight of 210.66 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-1-ethylpyrrolo[2,3-b]pyridin-2-yl)methanol is sourced from PubChem (CID 59471428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).