(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone

C11H9ClN2O2S — CID 59233501

IUPAC(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)sc2N)cn1
InChIInChI=1S/C11H9ClN2O2S/c1-16-9-3-2-6(5-14-9)10(15)7-4-8(12)17-11(7)13/h2-5H,13H2,1H3
InChIKeyBMOZMQYBAHNPEF-UHFFFAOYSA-N
MW268.73 g/mol
LogP2.62
Rot. Bonds3

About (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone

(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone (PubChem CID 59233501) has the molecular formula C11H9ClN2O2S and a molecular weight of 268.73 g/mol. Its IUPAC name is (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone
PubChem CID59233501
Molecular FormulaC11H9ClN2O2S
Molecular Weight268.73 g/mol
Exact Mass268.01
IUPAC Name(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone
SMILESCOc1ccc(C(=O)c2cc(Cl)sc2N)cn1
InChIInChI=1S/C11H9ClN2O2S/c1-16-9-3-2-6(5-14-9)10(15)7-4-8(12)17-11(7)13/h2-5H,13H2,1H3
InChIKeyBMOZMQYBAHNPEF-UHFFFAOYSA-N
XLogP2.62
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.73
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(6-methoxy-3-pyridinyl)-(6H-thieno[2,3-b]pyrrol-2-yl)methanone
CID 123611999
6-methoxypyridine-3-carboxylate
CID 7060527
ethane;1-(6-methoxy-3-pyridinyl)ethanone
CID 142833845
N'-(4-chlorobenzoyl)-6-methoxypyridine-3-carbohydrazide
CID 27007451
4-chloro-3-[(6-methoxypyridine-3-carbonyl)amino]benzoic acid
CID 43358856
(6-methoxy-3-pyridinyl)-(1H-pyrrol-2-yl)methanone
CID 130594883
[4-(3,5-dichlorobenzoyl)piperazin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 134063116
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168
(2-amino-5-ethylthiophen-3-yl)-(4-chlorophenyl)methanone
CID 18974891
N-(4-bromo-2-chlorophenyl)-6-methoxypyridine-3-carboxamide
CID 134016007
2-N-(6-methoxy-3-pyridinyl)pyridine-2,5-dicarboxamide
CID 154047378
N-(2-amino-2-oxoethoxy)-6-methoxypyridine-3-carboxamide
CID 112550755

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone?
The IUPAC name of (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone (CID 59233501) is (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone.
What is the SMILES notation for (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone?
The canonical SMILES for (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone is COc1ccc(C(=O)c2cc(Cl)sc2N)cn1.
What is the InChIKey of (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone?
The InChIKey is BMOZMQYBAHNPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O2S/c1-16-9-3-2-6(5-14-9)10(15)7-4-8(12)17-11(7)13/h2-5H,13H2,1H3.
What are the key properties of (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone?
(2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone has a molecular weight of 268.73 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-chlorothiophen-3-yl)-(6-methoxy-3-pyridinyl)methanone is sourced from PubChem (CID 59233501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).