N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide

C8H18N4O3S — CID 170311116

IUPACN-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide
SMILESCC(C)NC(=O)C1CNCCN1S(N)(=O)=O
InChIInChI=1S/C8H18N4O3S/c1-6(2)11-8(13)7-5-10-3-4-12(7)16(9,14)15/h6-7,10H,3-5H2,1-2H3,(H,11,13)(H2,9,14,15)
InChIKeyOLVAJFRQTYNNSQ-UHFFFAOYSA-N
MW250.32 g/mol
LogP-2.01
Rot. Bonds3

About N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide

N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide (PubChem CID 170311116) has the molecular formula C8H18N4O3S and a molecular weight of 250.32 g/mol. Its IUPAC name is N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide
PubChem CID170311116
Molecular FormulaC8H18N4O3S
Molecular Weight250.32 g/mol
Exact Mass250.11
IUPAC NameN-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide
SMILESCC(C)NC(=O)C1CNCCN1S(N)(=O)=O
InChIInChI=1S/C8H18N4O3S/c1-6(2)11-8(13)7-5-10-3-4-12(7)16(9,14)15/h6-7,10H,3-5H2,1-2H3,(H,11,13)(H2,9,14,15)
InChIKeyOLVAJFRQTYNNSQ-UHFFFAOYSA-N
XLogP-2.01
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 5-2.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide?
The IUPAC name of N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide (CID 170311116) is N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide.
What is the SMILES notation for N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide?
The canonical SMILES for N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide is CC(C)NC(=O)C1CNCCN1S(N)(=O)=O.
What is the InChIKey of N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide?
The InChIKey is OLVAJFRQTYNNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O3S/c1-6(2)11-8(13)7-5-10-3-4-12(7)16(9,14)15/h6-7,10H,3-5H2,1-2H3,(H,11,13)(H2,9,14,15).
What are the key properties of N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide?
N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide has a molecular weight of 250.32 g/mol, XLogP of -2.01, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-sulfamoylpiperazine-2-carboxamide is sourced from PubChem (CID 170311116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).