4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide

C9H14N4O2 — CID 66236271

IUPAC4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NCc1ccn[nH]1
InChIInChI=1S/C9H14N4O2/c10-8-5-15-4-7(8)9(14)11-3-6-1-2-12-13-6/h1-2,7-8H,3-5,10H2,(H,11,14)(H,12,13)
InChIKeyYTQOCELSBUWBQA-UHFFFAOYSA-N
MW210.24 g/mol
LogP-1.00
Rot. Bonds3

About 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide

4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide (PubChem CID 66236271) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide
PubChem CID66236271
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NCc1ccn[nH]1
InChIInChI=1S/C9H14N4O2/c10-8-5-15-4-7(8)9(14)11-3-6-1-2-12-13-6/h1-2,7-8H,3-5,10H2,(H,11,14)(H,12,13)
InChIKeyYTQOCELSBUWBQA-UHFFFAOYSA-N
XLogP-1.00
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-1.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(4-fluorophenyl)methyl]oxolane-3-carboxamide
CID 66239603
2-(1H-pyrazol-5-ylmethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 61283327
N-(1H-pyrazol-5-ylmethyl)bicyclo[2.2.1]hept-5-ene-2-carboxamide
CID 61284123
4-methyl-2-(1H-pyrazol-5-ylmethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114390788
4-amino-N-[(3-ethyl-2-pyridinyl)methyl]oxolane-3-carboxamide
CID 82737954
N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
CID 60977507
(2S)-N-(1H-pyrazol-5-ylmethyl)oxolane-2-carboxamide
CID 103872510
4-amino-N-[(4-propan-2-ylphenyl)methyl]oxolane-3-carboxamide
CID 66236279
5-oxo-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 78983105
(3S)-N-(1H-pyrazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 94916818
methyl 4-[[(4-aminooxolane-3-carbonyl)amino]methyl]benzoate
CID 66237277
(3S,4R)-4-(1H-pyrazol-5-ylmethylamino)oxolan-3-ol
CID 130680255

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide (CID 66236271) is 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide is NC1COCC1C(=O)NCc1ccn[nH]1.
What is the InChIKey of 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide?
The InChIKey is YTQOCELSBUWBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c10-8-5-15-4-7(8)9(14)11-3-6-1-2-12-13-6/h1-2,7-8H,3-5,10H2,(H,11,14)(H,12,13).
What are the key properties of 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide?
4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide has a molecular weight of 210.24 g/mol, XLogP of -1.00, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1H-pyrazol-5-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 66236271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).