N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide

C14H13N3OS — CID 134050773

IUPACN-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide
SMILESO=C(CCc1cccs1)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C14H13N3OS/c18-14(6-4-12-2-1-7-19-12)16-11-3-5-13-10(8-11)9-15-17-13/h1-3,5,7-9H,4,6H2,(H,15,17)(H,16,18)
InChIKeyRHEWQHDLOWLFOL-UHFFFAOYSA-N
MW271.35 g/mol
LogP3.20
Rot. Bonds4

About N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide

N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide (PubChem CID 134050773) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide
PubChem CID134050773
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC NameN-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide
SMILESO=C(CCc1cccs1)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C14H13N3OS/c18-14(6-4-12-2-1-7-19-12)16-11-3-5-13-10(8-11)9-15-17-13/h1-3,5,7-9H,4,6H2,(H,15,17)(H,16,18)
InChIKeyRHEWQHDLOWLFOL-UHFFFAOYSA-N
XLogP3.20
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(1H-indazol-5-yl)propanamide
CID 17164503
4-hydroxy-N-(1H-indazol-5-yl)butanamide
CID 79200157
N-(1H-indazol-5-yl)-4,4-dimethylpentanamide
CID 155236090
3-(4-bromothiophen-2-yl)-N-(1H-indazol-6-yl)propanamide
CID 166179582
N-(1H-indazol-5-yl)-3-[(2-phenylacetyl)amino]propanamide
CID 134037553
3-(5-bromothiophen-2-yl)-N-(1H-indazol-6-yl)propanamide
CID 166365205
4-[benzyl(methyl)amino]-N-(1H-indazol-5-yl)butanamide
CID 18447148
N-(4-iodophenyl)-3-thiophen-2-ylpropanamide
CID 2991783
3-(cyclopropylamino)-N-(1H-indazol-5-yl)propanamide
CID 60866208
3-(3-thiophen-2-ylpropanoylamino)benzamide
CID 17436122
2-(4-hydroxyphenyl)-N-(1H-indazol-5-yl)acetamide
CID 23570801
N-(1,2,3,4-tetrahydroisoquinolin-7-yl)-3-thiophen-2-ylpropanamide
CID 75482522

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide?
The IUPAC name of N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide (CID 134050773) is N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide is O=C(CCc1cccs1)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide?
The InChIKey is RHEWQHDLOWLFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c18-14(6-4-12-2-1-7-19-12)16-11-3-5-13-10(8-11)9-15-17-13/h1-3,5,7-9H,4,6H2,(H,15,17)(H,16,18).
What are the key properties of N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide?
N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide has a molecular weight of 271.35 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-yl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 134050773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).