1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide

C15H22N4OS — CID 119427314

IUPAC1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCC(C)c1nn(C)c2sc(C(=O)NC3CCCNC3)cc12
InChIInChI=1S/C15H22N4OS/c1-9(2)13-11-7-12(21-15(11)19(3)18-13)14(20)17-10-5-4-6-16-8-10/h7,9-10,16H,4-6,8H2,1-3H3,(H,17,20)
InChIKeyPPICQUCMRGNSQL-UHFFFAOYSA-N
MW306.44 g/mol
LogP2.24
Rot. Bonds3

About 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide

1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide (PubChem CID 119427314) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
PubChem CID119427314
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCC(C)c1nn(C)c2sc(C(=O)NC3CCCNC3)cc12
InChIInChI=1S/C15H22N4OS/c1-9(2)13-11-7-12(21-15(11)19(3)18-13)14(20)17-10-5-4-6-16-8-10/h7,9-10,16H,4-6,8H2,1-3H3,(H,17,20)
InChIKeyPPICQUCMRGNSQL-UHFFFAOYSA-N
XLogP2.24
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide with MolForge

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Related Compounds

cis-(1S,3R)-3-[(1-methyl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120675311
4,5-dibromo-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide
CID 103866520
4,5-dibromo-N-piperidin-3-ylthiophene-2-carboxamide
CID 80537940
1,4-diazepan-1-yl-(1-methyl-3-propan-2-ylthieno[3,2-d]pyrazol-5-yl)methanone;hydrochloride
CID 119416965
1,3-dimethyl-N-(2-piperidin-3-ylethyl)thieno[3,2-d]pyrazole-5-carboxamide
CID 119557464
(1-methyl-3-propan-2-ylthieno[3,2-d]pyrazol-5-yl)-piperazin-1-ylmethanone;hydrochloride
CID 119402426
5-bromo-4-methyl-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide
CID 103866666
1-methyl-N-[(2S)-oxan-2-yl]oxy-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 96560834
4,7-dibromo-N-piperidin-3-yl-1-benzothiophene-2-carboxamide
CID 145194357
N-[1-(aminomethyl)cyclopentyl]-1-methyl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 119567082
N-cyclobutyl-3-[(3-fluoropropanoylamino)methyl]-1-methylthieno[2,3-c]pyrazole-5-carboxamide
CID 131689572
3-methyl-1-phenyl-N-pyrrolidin-3-ylthieno[3,2-d]pyrazole-5-carboxamide;hydrochloride
CID 119450686

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide?
The IUPAC name of 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide (CID 119427314) is 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide.
What is the SMILES notation for 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide?
The canonical SMILES for 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide is CC(C)c1nn(C)c2sc(C(=O)NC3CCCNC3)cc12.
What is the InChIKey of 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide?
The InChIKey is PPICQUCMRGNSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-9(2)13-11-7-12(21-15(11)19(3)18-13)14(20)17-10-5-4-6-16-8-10/h7,9-10,16H,4-6,8H2,1-3H3,(H,17,20).
What are the key properties of 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide?
1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide has a molecular weight of 306.44 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-piperidin-3-yl-3-propan-2-ylthieno[3,2-d]pyrazole-5-carboxamide is sourced from PubChem (CID 119427314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).