2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide

C9H15N3O2 — CID 115870664

IUPAC2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide
SMILESCOC(C)C(=O)NCc1ccn(C)n1
InChIInChI=1S/C9H15N3O2/c1-7(14-3)9(13)10-6-8-4-5-12(2)11-8/h4-5,7H,6H2,1-3H3,(H,10,13)
InChIKeyWJZADPKBRVNACJ-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.07
Rot. Bonds4

About 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide

2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide (PubChem CID 115870664) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide.

Molecular Properties

Compound Name2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide
PubChem CID115870664
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide
SMILESCOC(C)C(=O)NCc1ccn(C)n1
InChIInChI=1S/C9H15N3O2/c1-7(14-3)9(13)10-6-8-4-5-12(2)11-8/h4-5,7H,6H2,1-3H3,(H,10,13)
InChIKeyWJZADPKBRVNACJ-UHFFFAOYSA-N
XLogP0.07
TPSA56.15 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 ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-N-[(1-methylpyrazol-3-yl)methyl]propanamide
CID 107905639
2-methyl-3-[(1-methylpyrazol-3-yl)methylamino]-3-oxopropanoic acid
CID 114898886
(2S)-2-amino-3-methyl-N-[(1-methylpyrazol-3-yl)methyl]butanamide
CID 82882870
2-ethyl-N-[(1-methylpyrazol-3-yl)methyl]butanamide
CID 19329164
(2R)-2-amino-N-[(1-methylpyrazol-3-yl)methyl]butanamide
CID 82873249
2-chloro-N-[(1-methylpyrazol-3-yl)methylcarbamoyl]propanamide
CID 82873706
methyl 2-(1-methylpyrazol-3-yl)acetate
CID 13269736
2-amino-N-[(1-methylpyrazol-3-yl)methyl]-4-methylsulfonylbutanamide
CID 82881520
N-(3-methoxypropyl)-2-[(1-methylpyrazol-3-yl)methylamino]propanamide
CID 82882044
2-cyano-N-[(1-methylpyrazol-3-yl)methyl]-3-phenylpropanamide
CID 82873118
2,2-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]propanamide
CID 82874484
(2S)-N-[(1-methylpyrazol-3-yl)methyl]-2-(4-phenylpyrazol-1-yl)propanamide
CID 100830781

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide?
The IUPAC name of 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide (CID 115870664) is 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide.
What is the SMILES notation for 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide?
The canonical SMILES for 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide is COC(C)C(=O)NCc1ccn(C)n1.
What is the InChIKey of 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide?
The InChIKey is WJZADPKBRVNACJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-7(14-3)9(13)10-6-8-4-5-12(2)11-8/h4-5,7H,6H2,1-3H3,(H,10,13).
What are the key properties of 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide?
2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide has a molecular weight of 197.24 g/mol, XLogP of 0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1-methylpyrazol-3-yl)methyl]propanamide is sourced from PubChem (CID 115870664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).