N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide

C9H15N3O2 — CID 178152321

IUPACN-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide
SMILESCC(=O)N(C)Cc1ccn(CCO)n1
InChIInChI=1S/C9H15N3O2/c1-8(14)11(2)7-9-3-4-12(10-9)5-6-13/h3-4,13H,5-7H2,1-2H3
InChIKeyBBJZUYOJTPUNAT-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.15
Rot. Bonds4

About N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide

N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide (PubChem CID 178152321) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide
PubChem CID178152321
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC NameN-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide
SMILESCC(=O)N(C)Cc1ccn(CCO)n1
InChIInChI=1S/C9H15N3O2/c1-8(14)11(2)7-9-3-4-12(10-9)5-6-13/h3-4,13H,5-7H2,1-2H3
InChIKeyBBJZUYOJTPUNAT-UHFFFAOYSA-N
XLogP-0.15
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[(1-ethylpyrazol-3-yl)methyl]-N-methylbenzamide
CID 19449817
N-[1-(2-hydroxyethyl)pyrazol-3-yl]acetamide
CID 141183209
4,5-dibromo-N-[(1-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
CID 19449890
4-[methyl-[(1-methylpyrazol-3-yl)methyl]amino]-4-oxobutanoic acid
CID 19620319
N-[(1-ethylpyrazol-3-yl)methyl]-N-methyl-3-(5-methylpyrazol-1-yl)propanamide
CID 19558354
2-[3-[(1-ethylpyrazol-3-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166587
3-(3-propylpyrazol-1-yl)propan-1-ol
CID 90288358
N-[(1-ethylpyrazol-3-yl)methyl]-N-methyl-2-(5-methylpyrazol-1-yl)acetamide
CID 19531117
N-[(1-ethylpyrazol-3-yl)methyl]-N,3,5-trimethyladamantane-1-carboxamide
CID 17021574
N-[(1-ethylpyrazol-3-yl)methyl]-3-(4-iodo-5-methylpyrazol-1-yl)-N-methylpropanamide
CID 19558406
3-(1-adamantyl)-1-[(1-ethylpyrazol-3-yl)methyl]-1-methylurea
CID 19456257
N-methyl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 58166119

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide?
The IUPAC name of N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide (CID 178152321) is N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide.
What is the SMILES notation for N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide?
The canonical SMILES for N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide is CC(=O)N(C)Cc1ccn(CCO)n1.
What is the InChIKey of N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide?
The InChIKey is BBJZUYOJTPUNAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-8(14)11(2)7-9-3-4-12(10-9)5-6-13/h3-4,13H,5-7H2,1-2H3.
What are the key properties of N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide?
N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide has a molecular weight of 197.24 g/mol, XLogP of -0.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-hydroxyethyl)pyrazol-3-yl]methyl]-N-methylacetamide is sourced from PubChem (CID 178152321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).