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

C10H16N4O2 — CID 64893014

IUPAC3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide
SMILESCN(Cc1cn[nH]c1)C(=O)C1(N)CCOC1
InChIInChI=1S/C10H16N4O2/c1-14(6-8-4-12-13-5-8)9(15)10(11)2-3-16-7-10/h4-5H,2-3,6-7,11H2,1H3,(H,12,13)
InChIKeyXKWCHVPLIHEWHW-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.51
Rot. Bonds3

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

3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide (PubChem CID 64893014) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide
PubChem CID64893014
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide
SMILESCN(Cc1cn[nH]c1)C(=O)C1(N)CCOC1
InChIInChI=1S/C10H16N4O2/c1-14(6-8-4-12-13-5-8)9(15)10(11)2-3-16-7-10/h4-5H,2-3,6-7,11H2,1H3,(H,12,13)
InChIKeyXKWCHVPLIHEWHW-UHFFFAOYSA-N
XLogP-0.51
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 ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]oxolane-3-carboxamide
CID 64893781
3-amino-N-[(3-hydroxyphenyl)methyl]-N-methyloxolane-3-carboxamide
CID 64893376
1-(aminomethyl)-N-methyl-N-(1H-pyrazol-4-ylmethyl)cyclobutane-1-carboxamide
CID 80599035
3-amino-N-[(3-bromophenyl)methyl]-N-methyloxolane-3-carboxamide
CID 64892163
3-amino-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]oxolane-3-carboxamide
CID 64891819
4-amino-N-benzyl-N-methyloxane-4-carboxamide
CID 115293535
3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide
CID 79378741
3-amino-N-[(2,3-dimethoxyphenyl)methyl]-N-methyloxolane-3-carboxamide
CID 64891744
N-methyl-3-propan-2-yl-N-(1H-pyrazol-4-ylmethyl)pyrrolidine-3-carboxamide
CID 106980739
3-amino-N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N-methyloxolane-3-carboxamide
CID 64892356
3-amino-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyloxolane-3-carboxamide
CID 64892140
2-(dimethylamino)-N-methyl-N-(1H-pyrazol-4-ylmethyl)acetamide
CID 102737443

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide (CID 64893014) is 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide is CN(Cc1cn[nH]c1)C(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide?
The InChIKey is XKWCHVPLIHEWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-14(6-8-4-12-13-5-8)9(15)10(11)2-3-16-7-10/h4-5H,2-3,6-7,11H2,1H3,(H,12,13).
What are the key properties of 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide?
3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide has a molecular weight of 224.26 g/mol, XLogP of -0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(1H-pyrazol-4-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 64893014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).