N-(1H-indazol-4-yl)propanamide

C10H11N3O — CID 61035756

IUPACN-(1H-indazol-4-yl)propanamide
SMILESCCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C10H11N3O/c1-2-10(14)12-8-4-3-5-9-7(8)6-11-13-9/h3-6H,2H2,1H3,(H,11,13)(H,12,14)
InChIKeyATKUQZVXPVTYQI-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.91
Rot. Bonds2

About N-(1H-indazol-4-yl)propanamide

N-(1H-indazol-4-yl)propanamide (PubChem CID 61035756) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is N-(1H-indazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(1H-indazol-4-yl)propanamide
PubChem CID61035756
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC NameN-(1H-indazol-4-yl)propanamide
SMILESCCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C10H11N3O/c1-2-10(14)12-8-4-3-5-9-7(8)6-11-13-9/h3-6H,2H2,1H3,(H,11,13)(H,12,14)
InChIKeyATKUQZVXPVTYQI-UHFFFAOYSA-N
XLogP1.91
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-4-yl)propanamide?
The IUPAC name of N-(1H-indazol-4-yl)propanamide (CID 61035756) is N-(1H-indazol-4-yl)propanamide.
What is the SMILES notation for N-(1H-indazol-4-yl)propanamide?
The canonical SMILES for N-(1H-indazol-4-yl)propanamide is CCC(=O)Nc1cccc2[nH]ncc12.
What is the InChIKey of N-(1H-indazol-4-yl)propanamide?
The InChIKey is ATKUQZVXPVTYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-2-10(14)12-8-4-3-5-9-7(8)6-11-13-9/h3-6H,2H2,1H3,(H,11,13)(H,12,14).
What are the key properties of N-(1H-indazol-4-yl)propanamide?
N-(1H-indazol-4-yl)propanamide has a molecular weight of 189.22 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-4-yl)propanamide is sourced from PubChem (CID 61035756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).