4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide

C11H18N4O2 — CID 66249426

IUPAC4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide
SMILESCCn1cc(NC(=O)C2(C)COCC2N)cn1
InChIInChI=1S/C11H18N4O2/c1-3-15-5-8(4-13-15)14-10(16)11(2)7-17-6-9(11)12/h4-5,9H,3,6-7,12H2,1-2H3,(H,14,16)
InChIKeySSYSQUDMDGQURL-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.21
Rot. Bonds3

About 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide

4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide (PubChem CID 66249426) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide
PubChem CID66249426
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide
SMILESCCn1cc(NC(=O)C2(C)COCC2N)cn1
InChIInChI=1S/C11H18N4O2/c1-3-15-5-8(4-13-15)14-10(16)11(2)7-17-6-9(11)12/h4-5,9H,3,6-7,12H2,1-2H3,(H,14,16)
InChIKeySSYSQUDMDGQURL-UHFFFAOYSA-N
XLogP0.21
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[(4-amino-3-methyloxolane-3-carbonyl)amino]pyrazol-1-yl]acetic acid
CID 66264017
1-amino-N-(1-ethylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119292190
4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide
CID 114912292
2-amino-1-methyl-N-[1-[2-(methylamino)-2-oxoethyl]pyrazol-4-yl]cyclopentane-1-carboxamide
CID 82765623
1-ethyl-3-(1-ethylpyrazol-4-yl)urea
CID 115581870
2-amino-N-[1-(2-methoxyethyl)pyrazol-4-yl]-1-methylcyclopentane-1-carboxamide
CID 82765458
4-amino-N-(3-carbamoyl-4-fluorophenyl)-3-methyloxolane-3-carboxamide
CID 66248653
4-[(1-ethylpyrazol-4-yl)carbamoylamino]oxolane-3-carboxylic acid
CID 66238549
2-amino-2-ethyl-N-(1-ethylpyrazol-4-yl)butanamide
CID 79810025
ethyl 2-[(1-ethylpyrazol-4-yl)amino]-2-oxoacetate
CID 60893384
N-(1-ethylpyrazol-4-yl)-3-propylpiperidine-3-carboxamide
CID 55166040
(1-ethylpyrazol-4-yl)thiourea
CID 43543607

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide (CID 66249426) is 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide is CCn1cc(NC(=O)C2(C)COCC2N)cn1.
What is the InChIKey of 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide?
The InChIKey is SSYSQUDMDGQURL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-3-15-5-8(4-13-15)14-10(16)11(2)7-17-6-9(11)12/h4-5,9H,3,6-7,12H2,1-2H3,(H,14,16).
What are the key properties of 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide?
4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethylpyrazol-4-yl)-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66249426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).