(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol

C12H10N2OS — CID 99645756

IUPAC(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol
SMILESO[C@@H](c1ccsc1)c1cc2ccncc2[nH]1
InChIInChI=1S/C12H10N2OS/c15-12(9-2-4-16-7-9)10-5-8-1-3-13-6-11(8)14-10/h1-7,12,14-15H/t12-/m0/s1
InChIKeyMNJCMBLUMKRQNG-LBPRGKRZSA-N
MW230.29 g/mol
LogP2.71
Rot. Bonds2

About (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol

(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol (PubChem CID 99645756) has the molecular formula C12H10N2OS and a molecular weight of 230.29 g/mol. Its IUPAC name is (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol.

Molecular Properties

Compound Name(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol
PubChem CID99645756
Molecular FormulaC12H10N2OS
Molecular Weight230.29 g/mol
Exact Mass230.05
IUPAC Name(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol
SMILESO[C@@H](c1ccsc1)c1cc2ccncc2[nH]1
InChIInChI=1S/C12H10N2OS/c15-12(9-2-4-16-7-9)10-5-8-1-3-13-6-11(8)14-10/h1-7,12,14-15H/t12-/m0/s1
InChIKeyMNJCMBLUMKRQNG-LBPRGKRZSA-N
XLogP2.71
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

furan-3-yl(1H-pyrrolo[2,3-c]pyridin-2-yl)methanol
CID 68982252
N-[(R)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]benzamide
CID 99645988
N-[(S)-phenyl(1H-pyrrolo[2,3-c]pyridin-2-yl)methyl]pyridine-4-carboxamide
CID 99645762
4-(1H-pyrrolo[2,3-c]pyridin-2-yl)-1,3-thiazole
CID 119090254
2-(4-methoxyphenyl)-2-(1H-pyrrolo[2,3-c]pyridin-2-yl)acetaldehyde
CID 87899514
(S)-(5-chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)-phenylmethanol
CID 99645909
trimethyl(1H-pyrrolo[2,3-c]pyridin-2-yl)silane
CID 15350909
1H-pyrrolo[2,3-c]pyridine-2-carbothioamide
CID 91621771
(6-methyl-3-pyridinyl)-thiophen-3-ylmethanol
CID 63155454
(3-chloropyrazin-2-yl)-thiophen-3-ylmethanol
CID 119085250
1H-pyrrolo[2,3-c]pyridin-2-ylhydrazine
CID 67216460
(2,6-dimethyl-3-pyridinyl)-thiophen-3-ylmethanol
CID 105102734

Frequently Asked Questions

What is the IUPAC name of (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol?
The IUPAC name of (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol (CID 99645756) is (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol.
What is the SMILES notation for (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol?
The canonical SMILES for (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol is O[C@@H](c1ccsc1)c1cc2ccncc2[nH]1.
What is the InChIKey of (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol?
The InChIKey is MNJCMBLUMKRQNG-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H10N2OS/c15-12(9-2-4-16-7-9)10-5-8-1-3-13-6-11(8)14-10/h1-7,12,14-15H/t12-/m0/s1.
What are the key properties of (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol?
(S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol has a molecular weight of 230.29 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-1H-pyrrolo[2,3-c]pyridin-2-yl(thiophen-3-yl)methanol is sourced from PubChem (CID 99645756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).