4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide

C10H17N3O2 — CID 80686901

IUPAC4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide
SMILESCn1cc(CCNC(=O)CCCO)cn1
InChIInChI=1S/C10H17N3O2/c1-13-8-9(7-12-13)4-5-11-10(15)3-2-6-14/h7-8,14H,2-6H2,1H3,(H,11,15)
InChIKeyJKLMXUDZAXZXLU-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.15
Rot. Bonds6

About 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide

4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide (PubChem CID 80686901) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide.

Molecular Properties

Compound Name4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide
PubChem CID80686901
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide
SMILESCn1cc(CCNC(=O)CCCO)cn1
InChIInChI=1S/C10H17N3O2/c1-13-8-9(7-12-13)4-5-11-10(15)3-2-6-14/h7-8,14H,2-6H2,1H3,(H,11,15)
InChIKeyJKLMXUDZAXZXLU-UHFFFAOYSA-N
XLogP-0.15
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[2-(1-methylpyrazol-4-yl)ethyl]pentanamide
CID 80683229
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-oxopentanamide
CID 80682207
3-(methylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]propanamide
CID 80682637
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(propan-2-ylamino)butanamide
CID 80683092
3-(tert-butylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]propanamide
CID 80682189
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)butanamide
CID 91838881
5-[3-(1-methylpyrazol-4-yl)propanoylamino]pentanoic acid
CID 119234671
N-[2-(1-methylpyrazol-4-yl)ethyl]-2-(4-sulfanylphenyl)acetamide
CID 107032863
1-[2-(1-methylpyrazol-4-yl)ethyl]-3-propylurea
CID 47239068
N-[2-(1-methylpyrazol-4-yl)ethyl]-3-phenoxypropanamide
CID 47352395
2-chloro-N-[2-(1-methylpyrazol-4-yl)ethylcarbamoyl]acetamide
CID 80688704
N-[2-(1-methylpyrazol-4-yl)ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924536

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide?
The IUPAC name of 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide (CID 80686901) is 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide.
What is the SMILES notation for 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide?
The canonical SMILES for 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide is Cn1cc(CCNC(=O)CCCO)cn1.
What is the InChIKey of 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide?
The InChIKey is JKLMXUDZAXZXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-13-8-9(7-12-13)4-5-11-10(15)3-2-6-14/h7-8,14H,2-6H2,1H3,(H,11,15).
What are the key properties of 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide?
4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide has a molecular weight of 211.26 g/mol, XLogP of -0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide is sourced from PubChem (CID 80686901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).