N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide

C16H20N4OS — CID 136542757

IUPACN-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cc2n(n1)CCCC2)N1CCCC1c1ccsc1
InChIInChI=1S/C16H20N4OS/c21-16(17-15-10-13-4-1-2-8-20(13)18-15)19-7-3-5-14(19)12-6-9-22-11-12/h6,9-11,14H,1-5,7-8H2,(H,17,18,21)
InChIKeyJOIDTLPYUJBYJL-UHFFFAOYSA-N
MW316.43 g/mol
LogP3.65
Rot. Bonds2

About N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide

N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide (PubChem CID 136542757) has the molecular formula C16H20N4OS and a molecular weight of 316.43 g/mol. Its IUPAC name is N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
PubChem CID136542757
Molecular FormulaC16H20N4OS
Molecular Weight316.43 g/mol
Exact Mass316.14
IUPAC NameN-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cc2n(n1)CCCC2)N1CCCC1c1ccsc1
InChIInChI=1S/C16H20N4OS/c21-16(17-15-10-13-4-1-2-8-20(13)18-15)19-7-3-5-14(19)12-6-9-22-11-12/h6,9-11,14H,1-5,7-8H2,(H,17,18,21)
InChIKeyJOIDTLPYUJBYJL-UHFFFAOYSA-N
XLogP3.65
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.43
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclopropyl-[(2R)-2-thiophen-3-ylpyrrolidin-1-yl]methanone
CID 94117667
(2S)-N-[(4-hydroxyphenyl)methyl]-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 94054166
N'-benzoyl-2-thiophen-3-ylpyrrolidine-1-carbohydrazide
CID 51124417
(2S)-N-(2-oxo-2-piperidin-1-ylethyl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 94103812
(2S)-N-(1H-indol-5-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 94821135
1-(2-thiophen-3-ylpiperidin-1-yl)ethanone
CID 102544384
3-[(2-thiophen-3-ylpyrrolidine-1-carbonyl)amino]propanoic acid
CID 122019398
N-(5-chloro-2-morpholin-4-ylphenyl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 55702129
2,2-dimethyl-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one
CID 64591656
(5S)-5-[(2S)-2-thiophen-3-ylpyrrolidine-1-carbonyl]piperidin-2-one
CID 94171138
N-[3-oxo-3-(2-thiophen-3-ylpyrrolidin-1-yl)propyl]cyclopentanecarboxamide
CID 47036904
(2R)-N-(3-pyrazol-1-ylpropyl)-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 94030715

Frequently Asked Questions

What is the IUPAC name of N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide?
The IUPAC name of N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide (CID 136542757) is N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide?
The canonical SMILES for N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide is O=C(Nc1cc2n(n1)CCCC2)N1CCCC1c1ccsc1.
What is the InChIKey of N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide?
The InChIKey is JOIDTLPYUJBYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4OS/c21-16(17-15-10-13-4-1-2-8-20(13)18-15)19-7-3-5-14(19)12-6-9-22-11-12/h6,9-11,14H,1-5,7-8H2,(H,17,18,21).
What are the key properties of N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide?
N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide has a molecular weight of 316.43 g/mol, XLogP of 3.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-2-thiophen-3-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 136542757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).