4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

C19H21N5OS — CID 127930065

IUPAC4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESCCC1c2ccsc2CCN1C(=O)Nc1ccnn1-c1cc(C)ccn1
InChIInChI=1S/C19H21N5OS/c1-3-15-14-7-11-26-16(14)6-10-23(15)19(25)22-17-5-9-21-24(17)18-12-13(2)4-8-20-18/h4-5,7-9,11-12,15H,3,6,10H2,1-2H3,(H,22,25)
InChIKeyZZMCEXGUXOXCTL-UHFFFAOYSA-N
MW367.48 g/mol
LogP4.18
Rot. Bonds3

About 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide

4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (PubChem CID 127930065) has the molecular formula C19H21N5OS and a molecular weight of 367.48 g/mol. Its IUPAC name is 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
PubChem CID127930065
Molecular FormulaC19H21N5OS
Molecular Weight367.48 g/mol
Exact Mass367.15
IUPAC Name4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
SMILESCCC1c2ccsc2CCN1C(=O)Nc1ccnn1-c1cc(C)ccn1
InChIInChI=1S/C19H21N5OS/c1-3-15-14-7-11-26-16(14)6-10-23(15)19(25)22-17-5-9-21-24(17)18-12-13(2)4-8-20-18/h4-5,7-9,11-12,15H,3,6,10H2,1-2H3,(H,22,25)
InChIKeyZZMCEXGUXOXCTL-UHFFFAOYSA-N
XLogP4.18
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.48
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 47760186
(4R)-4-ethyl-N-(4-methyl-3-oxopyrazin-2-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 124616346
1-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-3-[2-(1,3-thiazol-2-yl)ethyl]urea
CID 86800621
(2-chloro-4-pyridinyl)-[(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
CID 93418573
(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-(2-fluoro-4-pyridinyl)methanone
CID 61293484
4-ethyl-N-(4-propylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 112824907
N-(1,3-benzothiazol-2-yl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 71898973
4-ethyl-N-(3-pyrrol-1-ylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 56583833
(4R)-4-ethyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 94121250
(4R)-N-(1,3-benzothiazol-2-yl)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 38280106
(4S)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 95756653
4-ethyl-N-[2-(2-methoxyethoxy)phenyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 47493448

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The IUPAC name of 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide (CID 127930065) is 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide.
What is the SMILES notation for 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The canonical SMILES for 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is CCC1c2ccsc2CCN1C(=O)Nc1ccnn1-c1cc(C)ccn1.
What is the InChIKey of 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
The InChIKey is ZZMCEXGUXOXCTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5OS/c1-3-15-14-7-11-26-16(14)6-10-23(15)19(25)22-17-5-9-21-24(17)18-12-13(2)4-8-20-18/h4-5,7-9,11-12,15H,3,6,10H2,1-2H3,(H,22,25).
What are the key properties of 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide?
4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide has a molecular weight of 367.48 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(4-methyl-2-pyridinyl)pyrazol-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide is sourced from PubChem (CID 127930065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).