1-methyl-3-(1-nitrosoethyl)indazole

C10H11N3O — CID 123266859

IUPAC1-methyl-3-(1-nitrosoethyl)indazole
SMILESCC(N=O)c1nn(C)c2ccccc12
InChIInChI=1S/C10H11N3O/c1-7(12-14)10-8-5-3-4-6-9(8)13(2)11-10/h3-7H,1-2H3
InChIKeyULDAUTACJSRRHY-UHFFFAOYSA-N
MW189.22 g/mol
LogP2.40
Rot. Bonds2

About 1-methyl-3-(1-nitrosoethyl)indazole

1-methyl-3-(1-nitrosoethyl)indazole (PubChem CID 123266859) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-methyl-3-(1-nitrosoethyl)indazole.

Molecular Properties

Compound Name1-methyl-3-(1-nitrosoethyl)indazole
PubChem CID123266859
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-methyl-3-(1-nitrosoethyl)indazole
SMILESCC(N=O)c1nn(C)c2ccccc12
InChIInChI=1S/C10H11N3O/c1-7(12-14)10-8-5-3-4-6-9(8)13(2)11-10/h3-7H,1-2H3
InChIKeyULDAUTACJSRRHY-UHFFFAOYSA-N
XLogP2.40
TPSA47.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-(1-methylindazol-3-yl)ethanamine
CID 96741257
3-(difluoromethyl)-1-methylindazole
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2-amino-2-(1-methylindazol-3-yl)ethanol
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3-methyl-1-(1-methylindazol-3-yl)pentan-1-ol
CID 103128712
1-(1-methylindazol-3-yl)-2-propan-2-yloxyethanol
CID 103129050
1-(1-methylindazol-3-yl)propylhydrazine
CID 103129371
S-[1-(1-methylindazol-3-yl)ethyl] N-formylcarbamothioate
CID 142623416
2-ethyl-1-(1-methylindazol-3-yl)-N-propylbutan-1-amine
CID 103127777
3-methyl-1-(1-methylindazol-3-yl)hexan-1-amine
CID 103126789
(2,3-difluoro-4-methylphenyl)-(1-methylindazol-3-yl)methanamine
CID 107516114
(2-chlorophenyl)-(1-methylindazol-3-yl)methanamine
CID 103126271

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1-nitrosoethyl)indazole?
The IUPAC name of 1-methyl-3-(1-nitrosoethyl)indazole (CID 123266859) is 1-methyl-3-(1-nitrosoethyl)indazole.
What is the SMILES notation for 1-methyl-3-(1-nitrosoethyl)indazole?
The canonical SMILES for 1-methyl-3-(1-nitrosoethyl)indazole is CC(N=O)c1nn(C)c2ccccc12.
What is the InChIKey of 1-methyl-3-(1-nitrosoethyl)indazole?
The InChIKey is ULDAUTACJSRRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7(12-14)10-8-5-3-4-6-9(8)13(2)11-10/h3-7H,1-2H3.
What are the key properties of 1-methyl-3-(1-nitrosoethyl)indazole?
1-methyl-3-(1-nitrosoethyl)indazole has a molecular weight of 189.22 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1-nitrosoethyl)indazole is sourced from PubChem (CID 123266859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).