N-(6-chloro-1H-indazol-3-yl)propanamide

C10H10ClN3O — CID 10466174

IUPACN-(6-chloro-1H-indazol-3-yl)propanamide
SMILESCCC(=O)Nc1n[nH]c2cc(Cl)ccc12
InChIInChI=1S/C10H10ClN3O/c1-2-9(15)12-10-7-4-3-6(11)5-8(7)13-14-10/h3-5H,2H2,1H3,(H2,12,13,14,15)
InChIKeyIKVFCZWOEIOPJS-UHFFFAOYSA-N
MW223.66 g/mol
LogP2.56
Rot. Bonds2

About N-(6-chloro-1H-indazol-3-yl)propanamide

N-(6-chloro-1H-indazol-3-yl)propanamide (PubChem CID 10466174) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is N-(6-chloro-1H-indazol-3-yl)propanamide.

Molecular Properties

Compound NameN-(6-chloro-1H-indazol-3-yl)propanamide
PubChem CID10466174
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC NameN-(6-chloro-1H-indazol-3-yl)propanamide
SMILESCCC(=O)Nc1n[nH]c2cc(Cl)ccc12
InChIInChI=1S/C10H10ClN3O/c1-2-9(15)12-10-7-4-3-6(11)5-8(7)13-14-10/h3-5H,2H2,1H3,(H2,12,13,14,15)
InChIKeyIKVFCZWOEIOPJS-UHFFFAOYSA-N
XLogP2.56
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-1H-indazol-3-yl)propanamide?
The IUPAC name of N-(6-chloro-1H-indazol-3-yl)propanamide (CID 10466174) is N-(6-chloro-1H-indazol-3-yl)propanamide.
What is the SMILES notation for N-(6-chloro-1H-indazol-3-yl)propanamide?
The canonical SMILES for N-(6-chloro-1H-indazol-3-yl)propanamide is CCC(=O)Nc1n[nH]c2cc(Cl)ccc12.
What is the InChIKey of N-(6-chloro-1H-indazol-3-yl)propanamide?
The InChIKey is IKVFCZWOEIOPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c1-2-9(15)12-10-7-4-3-6(11)5-8(7)13-14-10/h3-5H,2H2,1H3,(H2,12,13,14,15).
What are the key properties of N-(6-chloro-1H-indazol-3-yl)propanamide?
N-(6-chloro-1H-indazol-3-yl)propanamide has a molecular weight of 223.66 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-1H-indazol-3-yl)propanamide is sourced from PubChem (CID 10466174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).