N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide

C18H21N5OS — CID 175650638

IUPACN,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCCN(c2nccc3sccc23)C1
InChIInChI=1S/C18H21N5OS/c1-21-11-13(10-20-21)18(24)22(2)14-4-3-8-23(12-14)17-15-6-9-25-16(15)5-7-19-17/h5-7,9-11,14H,3-4,8,12H2,1-2H3
InChIKeyPHDCCXPSADEXRG-UHFFFAOYSA-N
MW355.47 g/mol
LogP2.77
Rot. Bonds3

About N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide

N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide (PubChem CID 175650638) has the molecular formula C18H21N5OS and a molecular weight of 355.47 g/mol. Its IUPAC name is N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide
PubChem CID175650638
Molecular FormulaC18H21N5OS
Molecular Weight355.47 g/mol
Exact Mass355.15
IUPAC NameN,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCCN(c2nccc3sccc23)C1
InChIInChI=1S/C18H21N5OS/c1-21-11-13(10-20-21)18(24)22(2)14-4-3-8-23(12-14)17-15-6-9-25-16(15)5-7-19-17/h5-7,9-11,14H,3-4,8,12H2,1-2H3
InChIKeyPHDCCXPSADEXRG-UHFFFAOYSA-N
XLogP2.77
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.47
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(1-methylpyrazol-4-yl)-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)methanone
CID 172902883
N-[1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidin-3-yl]-N,1-dimethylpyrazole-4-carboxamide
CID 175650748
N-[1-(5-bromopyrimidin-2-yl)piperidin-3-yl]-N,1-dimethylpyrazole-4-carboxamide
CID 175649076
N-[1-(4-cyanopyrimidin-2-yl)piperidin-3-yl]-N,1-dimethylpyrazole-4-carboxamide
CID 175649067
N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide
CID 172903018
N,1-dimethyl-N-[1-(4-methylsulfonylphenyl)piperidin-3-yl]pyrazole-4-carboxamide
CID 175650104
(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)-thiomorpholin-4-ylmethanone
CID 163346136
1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
CID 172899862
N,1-dimethyl-N-[1-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperidin-3-yl]pyrazole-4-carboxamide
CID 175651238
N,1-dimethyl-N-(1-quinolin-4-ylpiperidin-4-yl)pyrazole-4-carboxamide
CID 175650893
N-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-3-yl)cyclopropanecarboxamide
CID 166602913
(3S)-N-[(4-ethylphenyl)methyl]-1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
CID 92899054

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide?
The IUPAC name of N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide (CID 175650638) is N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide?
The canonical SMILES for N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide is CN(C(=O)c1cnn(C)c1)C1CCCN(c2nccc3sccc23)C1.
What is the InChIKey of N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide?
The InChIKey is PHDCCXPSADEXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5OS/c1-21-11-13(10-20-21)18(24)22(2)14-4-3-8-23(12-14)17-15-6-9-25-16(15)5-7-19-17/h5-7,9-11,14H,3-4,8,12H2,1-2H3.
What are the key properties of N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide?
N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide has a molecular weight of 355.47 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-(1-thieno[3,2-c]pyridin-4-ylpiperidin-3-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 175650638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).