N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide

C7H11N3O2 — CID 166160342

IUPACN-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide
SMILESCc1nn(CCO)cc1NC=O
InChIInChI=1S/C7H11N3O2/c1-6-7(8-5-12)4-10(9-6)2-3-11/h4-5,11H,2-3H2,1H3,(H,8,12)
InChIKeyUXQXXGNZTHETFS-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.25
Rot. Bonds4

About N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide

N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide (PubChem CID 166160342) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide.

Molecular Properties

Compound NameN-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide
PubChem CID166160342
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC NameN-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide
SMILESCc1nn(CCO)cc1NC=O
InChIInChI=1S/C7H11N3O2/c1-6-7(8-5-12)4-10(9-6)2-3-11/h4-5,11H,2-3H2,1H3,(H,8,12)
InChIKeyUXQXXGNZTHETFS-UHFFFAOYSA-N
XLogP-0.25
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;2-(4-ethyl-3-methylpyrazol-1-yl)ethanol
CID 169138415
1-ethyl-4-formamidopyrazole-3-carboxamide
CID 4777031
N-[(1,3-dimethylpyrazol-4-yl)methyl]-3-methyl-1-propylpyrazol-4-amine
CID 122166677
3-methyl-N-[(3-methyl-1-propylpyrazol-4-yl)methyl]-1-propylpyrazol-4-amine
CID 122167638
N-[2-(2-hydroxyethyl)pyrazol-3-yl]formamide
CID 15077737
2-(4-bromo-3-methylpyrazol-1-yl)-N-(1,3-dimethylpyrazol-4-yl)acetamide
CID 19346068
2-[3-[(Z)-but-1-enyl]-4-methylpyrazol-1-yl]ethanol
CID 139502967
3-ethyl-1-(2-hydroxyethyl)pyrazole-4-carboxylic acid
CID 39870092
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-methyl-1-propylpyrazol-4-amine
CID 122167189
3-methyl-N-[(3-methyl-1-propan-2-ylpyrazol-4-yl)methyl]-1-propylpyrazol-4-amine
CID 122167543
3-(4-iodo-3-methylpyrazol-1-yl)propanal
CID 90289557
N-(1,2-dimethylimidazol-4-yl)formamide
CID 168980267

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide?
The IUPAC name of N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide (CID 166160342) is N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide.
What is the SMILES notation for N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide?
The canonical SMILES for N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide is Cc1nn(CCO)cc1NC=O.
What is the InChIKey of N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide?
The InChIKey is UXQXXGNZTHETFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-6-7(8-5-12)4-10(9-6)2-3-11/h4-5,11H,2-3H2,1H3,(H,8,12).
What are the key properties of N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide?
N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide has a molecular weight of 169.18 g/mol, XLogP of -0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxyethyl)-3-methylpyrazol-4-yl]formamide is sourced from PubChem (CID 166160342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).