5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide

C10H16N4O2 — CID 61435935

IUPAC5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESCN(CC1CCCO1)C(=O)c1cn[nH]c1N
InChIInChI=1S/C10H16N4O2/c1-14(6-7-3-2-4-16-7)10(15)8-5-12-13-9(8)11/h5,7H,2-4,6H2,1H3,(H3,11,12,13)
InChIKeyMRUKPVNONWDINX-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.24
Rot. Bonds3

About 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide

5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide (PubChem CID 61435935) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide
PubChem CID61435935
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESCN(CC1CCCO1)C(=O)c1cn[nH]c1N
InChIInChI=1S/C10H16N4O2/c1-14(6-7-3-2-4-16-7)10(15)8-5-12-13-9(8)11/h5,7H,2-4,6H2,1H3,(H3,11,12,13)
InChIKeyMRUKPVNONWDINX-UHFFFAOYSA-N
XLogP0.24
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-methyl-N-(oxan-2-ylmethyl)-1H-pyrazole-4-carboxamide
CID 61435982
5-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1H-pyrazole-4-carboxamide
CID 63235520
5-amino-2,4-difluoro-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 61430371
4-amino-N-methyl-N-(oxolan-2-ylmethyl)benzamide;hydrochloride
CID 119708774
2-amino-3-fluoro-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 55100104
N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 110733149
4-amino-5-cyclopropyl-N-methyl-N-(oxan-2-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62080103
5-amino-2-chloro-N-methyl-N-(oxan-2-ylmethyl)benzamide
CID 61430467
5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 81315666
2-amino-3,5-dimethoxy-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 115950596
3-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 105069188
4-hydroxy-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 61436471

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide (CID 61435935) is 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide is CN(CC1CCCO1)C(=O)c1cn[nH]c1N.
What is the InChIKey of 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is MRUKPVNONWDINX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-14(6-7-3-2-4-16-7)10(15)8-5-12-13-9(8)11/h5,7H,2-4,6H2,1H3,(H3,11,12,13).
What are the key properties of 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide?
5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-(oxolan-2-ylmethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 61435935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).