N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide

C10H21N3O3S — CID 106918335

IUPACN,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide
SMILESCNC(=O)C(C)CN(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C10H21N3O3S/c1-8(10(14)11-2)7-13(3)17(15,16)9-4-5-12-6-9/h8-9,12H,4-7H2,1-3H3,(H,11,14)
InChIKeyFYTAEHLTLCTXBO-UHFFFAOYSA-N
MW263.36 g/mol
LogP-1.01
Rot. Bonds5

About N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide

N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide (PubChem CID 106918335) has the molecular formula C10H21N3O3S and a molecular weight of 263.36 g/mol. Its IUPAC name is N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide.

Molecular Properties

Compound NameN,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide
PubChem CID106918335
Molecular FormulaC10H21N3O3S
Molecular Weight263.36 g/mol
Exact Mass263.13
IUPAC NameN,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide
SMILESCNC(=O)C(C)CN(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C10H21N3O3S/c1-8(10(14)11-2)7-13(3)17(15,16)9-4-5-12-6-9/h8-9,12H,4-7H2,1-3H3,(H,11,14)
InChIKeyFYTAEHLTLCTXBO-UHFFFAOYSA-N
XLogP-1.01
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 5-1.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide?
The IUPAC name of N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide (CID 106918335) is N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide.
What is the SMILES notation for N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide?
The canonical SMILES for N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide is CNC(=O)C(C)CN(C)S(=O)(=O)C1CCNC1.
What is the InChIKey of N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide?
The InChIKey is FYTAEHLTLCTXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S/c1-8(10(14)11-2)7-13(3)17(15,16)9-4-5-12-6-9/h8-9,12H,4-7H2,1-3H3,(H,11,14).
What are the key properties of N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide?
N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide has a molecular weight of 263.36 g/mol, XLogP of -1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide is sourced from PubChem (CID 106918335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).