(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide

C14H22N4O4S — CID 97215975

IUPAC(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide
SMILESCn1cc(S(=O)(=O)N2CCC(NC(=O)[C@H]3CCCO3)CC2)cn1
InChIInChI=1S/C14H22N4O4S/c1-17-10-12(9-15-17)23(20,21)18-6-4-11(5-7-18)16-14(19)13-3-2-8-22-13/h9-11,13H,2-8H2,1H3,(H,16,19)/t13-/m1/s1
InChIKeyUSLUOPQGAMHLOL-CYBMUJFWSA-N
MW342.42 g/mol
LogP-0.13
Rot. Bonds4

About (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide

(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide (PubChem CID 97215975) has the molecular formula C14H22N4O4S and a molecular weight of 342.42 g/mol. Its IUPAC name is (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide
PubChem CID97215975
Molecular FormulaC14H22N4O4S
Molecular Weight342.42 g/mol
Exact Mass342.14
IUPAC Name(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide
SMILESCn1cc(S(=O)(=O)N2CCC(NC(=O)[C@H]3CCCO3)CC2)cn1
InChIInChI=1S/C14H22N4O4S/c1-17-10-12(9-15-17)23(20,21)18-6-4-11(5-7-18)16-14(19)13-3-2-8-22-13/h9-11,13H,2-8H2,1H3,(H,16,19)/t13-/m1/s1
InChIKeyUSLUOPQGAMHLOL-CYBMUJFWSA-N
XLogP-0.13
TPSA93.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide
CID 75373223
N-methyl-1-(1-methylpyrazol-4-yl)sulfonylpyrrolidin-3-amine
CID 115300352
2-amino-2-(4-methylphenyl)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]acetamide
CID 120668801
5-amino-2-methyl-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]benzamide
CID 120635627
2-amino-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]benzamide;hydrochloride
CID 119945720
N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119801200
N-[4-[2-(1-methylpyrazol-4-yl)ethylcarbamoyl]cyclohexyl]oxolane-2-carboxamide
CID 169418153
N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119801204
(2R)-N-cyclopropyloxolane-2-carboxamide
CID 40569533
(2R)-N-(4-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 975970
3-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]-1,2-oxazole-5-carboxylic acid
CID 146136179
6-[[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]amino]pyridine-2-carboxylic acid
CID 122053952

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide (CID 97215975) is (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide is Cn1cc(S(=O)(=O)N2CCC(NC(=O)[C@H]3CCCO3)CC2)cn1.
What is the InChIKey of (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide?
The InChIKey is USLUOPQGAMHLOL-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H22N4O4S/c1-17-10-12(9-15-17)23(20,21)18-6-4-11(5-7-18)16-14(19)13-3-2-8-22-13/h9-11,13H,2-8H2,1H3,(H,16,19)/t13-/m1/s1.
What are the key properties of (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide?
(2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide has a molecular weight of 342.42 g/mol, XLogP of -0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[1-(1-methylpyrazol-4-yl)sulfonylpiperidin-4-yl]oxolane-2-carboxamide is sourced from PubChem (CID 97215975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).