N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide

C9H13N3O2 — CID 60977507

IUPACN-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCc1ccn[nH]1)C1CCCO1
InChIInChI=1S/C9H13N3O2/c13-9(8-2-1-5-14-8)10-6-7-3-4-11-12-7/h3-4,8H,1-2,5-6H2,(H,10,13)(H,11,12)
InChIKeyYGCKJSZTNDZZHL-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.20
Rot. Bonds3

About N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide

N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide (PubChem CID 60977507) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
PubChem CID60977507
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC NameN-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
SMILESO=C(NCc1ccn[nH]1)C1CCCO1
InChIInChI=1S/C9H13N3O2/c13-9(8-2-1-5-14-8)10-6-7-3-4-11-12-7/h3-4,8H,1-2,5-6H2,(H,10,13)(H,11,12)
InChIKeyYGCKJSZTNDZZHL-UHFFFAOYSA-N
XLogP0.20
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
CID 103872510
(2R)-N-(1H-imidazol-5-ylmethyl)oxolane-2-carboxamide
CID 103850292
4-(oxolan-2-ylmethoxy)-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 91641650
(2R)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]oxolane-2-carboxamide
CID 103849971
N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]oxane-2-carboxamide
CID 118782143
2-(1H-pyrazol-5-ylmethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 61283327
N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide
CID 110779522
2-cyclobutyl-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 103706823
(2S)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]oxolane-2-carboxamide
CID 7626363
4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide
CID 66236271
6-oxo-N-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
CID 112731393
1-acetyl-N-(1H-pyrazol-5-ylmethyl)piperidine-4-carboxamide
CID 60976301

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide (CID 60977507) is N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide is O=C(NCc1ccn[nH]1)C1CCCO1.
What is the InChIKey of N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide?
The InChIKey is YGCKJSZTNDZZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c13-9(8-2-1-5-14-8)10-6-7-3-4-11-12-7/h3-4,8H,1-2,5-6H2,(H,10,13)(H,11,12).
What are the key properties of N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide?
N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 60977507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).