2-hydroxyethyl N-(1H-indazol-5-yl)carbamate

C10H11N3O3 — CID 79346712

IUPAC2-hydroxyethyl N-(1H-indazol-5-yl)carbamate
SMILESO=C(Nc1ccc2[nH]ncc2c1)OCCO
InChIInChI=1S/C10H11N3O3/c14-3-4-16-10(15)12-8-1-2-9-7(5-8)6-11-13-9/h1-2,5-6,14H,3-4H2,(H,11,13)(H,12,15)
InChIKeyLGPOBKPKDQQDEC-UHFFFAOYSA-N
MW221.22 g/mol
LogP1.10
Rot. Bonds3

About 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate

2-hydroxyethyl N-(1H-indazol-5-yl)carbamate (PubChem CID 79346712) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-(1H-indazol-5-yl)carbamate
PubChem CID79346712
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name2-hydroxyethyl N-(1H-indazol-5-yl)carbamate
SMILESO=C(Nc1ccc2[nH]ncc2c1)OCCO
InChIInChI=1S/C10H11N3O3/c14-3-4-16-10(15)12-8-1-2-9-7(5-8)6-11-13-9/h1-2,5-6,14H,3-4H2,(H,11,13)(H,12,15)
InChIKeyLGPOBKPKDQQDEC-UHFFFAOYSA-N
XLogP1.10
TPSA87.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate?
The IUPAC name of 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate (CID 79346712) is 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate.
What is the SMILES notation for 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate?
The canonical SMILES for 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate is O=C(Nc1ccc2[nH]ncc2c1)OCCO.
What is the InChIKey of 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate?
The InChIKey is LGPOBKPKDQQDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c14-3-4-16-10(15)12-8-1-2-9-7(5-8)6-11-13-9/h1-2,5-6,14H,3-4H2,(H,11,13)(H,12,15).
What are the key properties of 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate?
2-hydroxyethyl N-(1H-indazol-5-yl)carbamate has a molecular weight of 221.22 g/mol, XLogP of 1.10, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-(1H-indazol-5-yl)carbamate is sourced from PubChem (CID 79346712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).