2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide

C14H17N3O2 — CID 47286046

IUPAC2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
SMILESCC(OCc1ccccc1)C(=O)NCc1ccn[nH]1
InChIInChI=1S/C14H17N3O2/c1-11(19-10-12-5-3-2-4-6-12)14(18)15-9-13-7-8-16-17-13/h2-8,11H,9-10H2,1H3,(H,15,18)(H,16,17)
InChIKeyOLPVCRNODYYLKW-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.63
Rot. Bonds6

About 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide

2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide (PubChem CID 47286046) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide.

Molecular Properties

Compound Name2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
PubChem CID47286046
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
SMILESCC(OCc1ccccc1)C(=O)NCc1ccn[nH]1
InChIInChI=1S/C14H17N3O2/c1-11(19-10-12-5-3-2-4-6-12)14(18)15-9-13-7-8-16-17-13/h2-8,11H,9-10H2,1H3,(H,15,18)(H,16,17)
InChIKeyOLPVCRNODYYLKW-UHFFFAOYSA-N
XLogP1.63
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenylmethoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42959352
(2R)-N-benzyl-2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 95157473
(2S)-3-methyl-2-[(2-phenylacetyl)amino]-N-(1H-pyrazol-5-ylmethyl)butanamide
CID 94032780
2-amino-3-phenyl-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 61285504
2-acetamido-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 60975273
(2R)-N-[[4-(dimethylamino)phenyl]methyl]-2-phenylmethoxypropanamide
CID 39943771
3-chloro-2-methyl-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 62728534
2-bromo-3-methyl-N-(1H-pyrazol-5-ylmethyl)butanamide
CID 61285500
2,2-difluoro-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 103514034
2-hydroxy-3-(2-phenylmethoxypropanoylamino)propanoic acid
CID 66166214
(2S)-2-phenylmethoxy-N-(2-thiophen-3-ylethyl)propanamide
CID 94023398
N-[[2-(3-methylbutoxy)phenyl]methyl]-2-phenylmethoxypropanamide
CID 60618262

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The IUPAC name of 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide (CID 47286046) is 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide.
What is the SMILES notation for 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The canonical SMILES for 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide is CC(OCc1ccccc1)C(=O)NCc1ccn[nH]1.
What is the InChIKey of 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The InChIKey is OLPVCRNODYYLKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-11(19-10-12-5-3-2-4-6-12)14(18)15-9-13-7-8-16-17-13/h2-8,11H,9-10H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide has a molecular weight of 259.31 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide is sourced from PubChem (CID 47286046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).