N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide

C12H21N3O4S — CID 83104809

IUPACN-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide
SMILESO=C(NC1CC1)C1COCCN1S(=O)(=O)C1CCNC1
InChIInChI=1S/C12H21N3O4S/c16-12(14-9-1-2-9)11-8-19-6-5-15(11)20(17,18)10-3-4-13-7-10/h9-11,13H,1-8H2,(H,14,16)
InChIKeyRXQPZWOVZKOVOL-UHFFFAOYSA-N
MW303.38 g/mol
LogP-1.34
Rot. Bonds4

About N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide

N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide (PubChem CID 83104809) has the molecular formula C12H21N3O4S and a molecular weight of 303.38 g/mol. Its IUPAC name is N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide
PubChem CID83104809
Molecular FormulaC12H21N3O4S
Molecular Weight303.38 g/mol
Exact Mass303.13
IUPAC NameN-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide
SMILESO=C(NC1CC1)C1COCCN1S(=O)(=O)C1CCNC1
InChIInChI=1S/C12H21N3O4S/c16-12(14-9-1-2-9)11-8-19-6-5-15(11)20(17,18)10-3-4-13-7-10/h9-11,13H,1-8H2,(H,14,16)
InChIKeyRXQPZWOVZKOVOL-UHFFFAOYSA-N
XLogP-1.34
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.38
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-bromothiophen-2-yl)sulfonyl-N-cyclopropylmorpholine-3-carboxamide
CID 83105167
N-cyclopropyl-4-(2,2-dimethylpropanoyl)morpholine-3-carboxamide
CID 83104501
N-cyclopropyl-4-(2-sulfanylacetyl)morpholine-3-carboxamide
CID 83105257
N-(oxolan-3-yl)pyrrolidine-3-sulfonamide
CID 80714879
3-N-cyclopropyl-4-N-methylmorpholine-3,4-dicarboxamide
CID 116657472
N-(1-pyrrolidin-3-ylsulfonylpiperidin-4-yl)acetamide
CID 113402662
N-cyclopropyl-4-[4-(methylamino)cyclohexyl]morpholine-3-carboxamide
CID 114763535
N-cyclopropyl-4-(2-oxoethyl)morpholine-3-carboxamide
CID 83103250
4-[2-(azetidin-3-ylidene)propanoyl]-N-cyclopropylmorpholine-3-carboxamide
CID 116678797
(3R)-N-pyrrolidin-3-ylmorpholine-3-carboxamide;hydrochloride
CID 130748088
N-(oxan-3-yl)pyrrolidine-3-sulfonamide
CID 65418986
N-cyclopropyl-4-(2-hydrazinyl-2-oxoacetyl)morpholine-3-carboxamide
CID 83103627

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide?
The IUPAC name of N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide (CID 83104809) is N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide is O=C(NC1CC1)C1COCCN1S(=O)(=O)C1CCNC1.
What is the InChIKey of N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide?
The InChIKey is RXQPZWOVZKOVOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O4S/c16-12(14-9-1-2-9)11-8-19-6-5-15(11)20(17,18)10-3-4-13-7-10/h9-11,13H,1-8H2,(H,14,16).
What are the key properties of N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide?
N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide has a molecular weight of 303.38 g/mol, XLogP of -1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-pyrrolidin-3-ylsulfonylmorpholine-3-carboxamide is sourced from PubChem (CID 83104809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).