3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide

C10H16N4O2 — CID 64523047

IUPAC3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide
SMILESCC(NC(=O)c1cc(N)n[nH]1)C1CCCO1
InChIInChI=1S/C10H16N4O2/c1-6(8-3-2-4-16-8)12-10(15)7-5-9(11)14-13-7/h5-6,8H,2-4H2,1H3,(H,12,15)(H3,11,13,14)
InChIKeyZCTQDFXVIPOWCA-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.29
Rot. Bonds3

About 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide

3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide (PubChem CID 64523047) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide
PubChem CID64523047
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide
SMILESCC(NC(=O)c1cc(N)n[nH]1)C1CCCO1
InChIInChI=1S/C10H16N4O2/c1-6(8-3-2-4-16-8)12-10(15)7-5-9(11)14-13-7/h5-6,8H,2-4H2,1H3,(H,12,15)(H3,11,13,14)
InChIKeyZCTQDFXVIPOWCA-UHFFFAOYSA-N
XLogP0.29
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(1-cyclopentylethyl)-1H-pyrazole-5-carboxamide
CID 64523510
4-amino-5-methyl-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 62082095
5-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-2,5-dicarboxamide
CID 98786018
3,5-dimethyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]benzamide
CID 27233431
N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2H-benzotriazole-5-carboxamide
CID 35246882
3-amino-N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-1H-pyrazole-5-carboxamide
CID 64524412
4-amino-N-[1-(oxolan-2-yl)ethyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62075134
3-amino-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyrazole-5-carboxamide
CID 95369014
5-amino-2-chloro-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43533754
5-amino-N-[1-(oxolan-2-yl)ethyl]pyridine-2-carboxamide
CID 81316128
N-[1-(oxolan-2-yl)ethyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 43533899
2-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
CID 62242671

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide (CID 64523047) is 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide is CC(NC(=O)c1cc(N)n[nH]1)C1CCCO1.
What is the InChIKey of 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide?
The InChIKey is ZCTQDFXVIPOWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-6(8-3-2-4-16-8)12-10(15)7-5-9(11)14-13-7/h5-6,8H,2-4H2,1H3,(H,12,15)(H3,11,13,14).
What are the key properties of 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide?
3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.29, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(oxolan-2-yl)ethyl]-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 64523047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).