N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide

C19H18ClN3O2S — CID 86296954

IUPACN-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1OC1CCNCC1)c1csc2cccnc12
InChIInChI=1S/C19H18ClN3O2S/c20-12-3-4-16(25-13-5-8-21-9-6-13)15(10-12)23-19(24)14-11-26-17-2-1-7-22-18(14)17/h1-4,7,10-11,13,21H,5-6,8-9H2,(H,23,24)
InChIKeyPPIGWXNYCGUCMZ-UHFFFAOYSA-N
MW387.89 g/mol
LogP4.33
Rot. Bonds4

About N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide

N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide (PubChem CID 86296954) has the molecular formula C19H18ClN3O2S and a molecular weight of 387.89 g/mol. Its IUPAC name is N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide
PubChem CID86296954
Molecular FormulaC19H18ClN3O2S
Molecular Weight387.89 g/mol
Exact Mass387.08
IUPAC NameN-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1OC1CCNCC1)c1csc2cccnc12
InChIInChI=1S/C19H18ClN3O2S/c20-12-3-4-16(25-13-5-8-21-9-6-13)15(10-12)23-19(24)14-11-26-17-2-1-7-22-18(14)17/h1-4,7,10-11,13,21H,5-6,8-9H2,(H,23,24)
InChIKeyPPIGWXNYCGUCMZ-UHFFFAOYSA-N
XLogP4.33
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.89
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-Chloro-2-methoxyphenyl)-6-methyl-2-{[(pyridin-3-YL)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 4119742
2-[(6-Chloro-3-pyridinyl)oxymethyl]-7-(4-fluorophenyl)thieno[3,2-b]pyridine-5-carboxamide
CID 155521127
N-(5-chloro-2-propan-2-yloxyphenyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056178
N-[5-chloro-2-(4-hydroxycyclohexyl)oxyphenyl]thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056288
2-(2-aminoethylamino)-N-(5-chloro-2-methoxyphenyl)thieno[3,2-d]pyrimidine-7-carboxamide
CID 66664716
N-(5-chloro-2-methoxyphenyl)-2-[methyl(propyl)amino]thieno[3,2-d]pyrimidine-7-carboxamide
CID 117634614
N-(5-Chloro-2-methoxyphenyl)-2-{[(pyridin-3-YL)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 3254099
N-[2-(4-aminocyclohexyl)oxy-5-chlorophenyl]thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056086
N-(5-chloro-2-methoxyphenyl)-2-(2-hydroxyethylamino)thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056149
N-[5-chloro-2-(3-hydroxycyclopentyl)oxyphenyl]thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056205
N-(5-chloro-2-methoxyphenyl)thieno[3,2-b]pyridine-3-carboxamide
CID 58056224
N-[5-chloro-2-(4-hydroxy-2-methylbutan-2-yl)oxyphenyl]thieno[3,2-d]pyrimidine-7-carboxamide
CID 58056233

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide (CID 86296954) is N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide is O=C(Nc1cc(Cl)ccc1OC1CCNCC1)c1csc2cccnc12.
What is the InChIKey of N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide?
The InChIKey is PPIGWXNYCGUCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O2S/c20-12-3-4-16(25-13-5-8-21-9-6-13)15(10-12)23-19(24)14-11-26-17-2-1-7-22-18(14)17/h1-4,7,10-11,13,21H,5-6,8-9H2,(H,23,24).
What are the key properties of N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide?
N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide has a molecular weight of 387.89 g/mol, XLogP of 4.33, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-piperidin-4-yloxyphenyl)thieno[3,2-b]pyridine-3-carboxamide is sourced from PubChem (CID 86296954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).