2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide

C10H21N5O3S — CID 104978488

IUPAC2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide
SMILESNC(CN1CCC(NS(=O)(=O)NC2CC2)CC1)=NO
InChIInChI=1S/C10H21N5O3S/c11-10(12-16)7-15-5-3-9(4-6-15)14-19(17,18)13-8-1-2-8/h8-9,13-14,16H,1-7H2,(H2,11,12)
InChIKeyWNKQDTTWGFZBNJ-UHFFFAOYSA-N
MW291.38 g/mol
LogP-1.22
Rot. Bonds6

About 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide

2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide (PubChem CID 104978488) has the molecular formula C10H21N5O3S and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide
PubChem CID104978488
Molecular FormulaC10H21N5O3S
Molecular Weight291.38 g/mol
Exact Mass291.14
IUPAC Name2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide
SMILESNC(CN1CCC(NS(=O)(=O)NC2CC2)CC1)=NO
InChIInChI=1S/C10H21N5O3S/c11-10(12-16)7-15-5-3-9(4-6-15)14-19(17,18)13-8-1-2-8/h8-9,13-14,16H,1-7H2,(H2,11,12)
InChIKeyWNKQDTTWGFZBNJ-UHFFFAOYSA-N
XLogP-1.22
TPSA120.05 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 5-1.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-hydroxy-2-[4-[(5-methyl-1H-pyrazol-4-yl)sulfonylamino]piperidin-1-yl]ethanimidamide
CID 77002496
2-[4-(methylsulfamoylamino)piperidin-1-yl]ethanethioamide
CID 114808399
N-[1-(2-amino-2-hydroxyiminoethyl)piperidin-4-yl]-2-methylbutanamide
CID 77002434
N-[1-(2-amino-2-hydroxyiminoethyl)piperidin-4-yl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 77115236
2-[4-(2-fluoroethyl)piperidin-1-yl]-N'-hydroxyethanimidamide
CID 129496379
1-[1-[(2Z)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-3-propylurea
CID 55250006
2-[4-(bromomethylsulfonylamino)piperidin-1-yl]acetamide
CID 83084786
1-[1-(2-amino-2-hydroxyiminoethyl)piperidin-4-yl]-3-(2,2,2-trifluoroethyl)urea
CID 104858961
2-(4-cyclohexylsulfonylpiperazin-1-yl)-N'-hydroxyethanimidamide
CID 77011980
2-[(3S)-3-fluoropyrrolidin-1-yl]-N'-hydroxyethanimidamide
CID 129494574
N-[1-(2-amino-2-hydroxyiminoethyl)piperidin-4-yl]thiophene-3-carboxamide
CID 77002400
N-[1-[(2E)-2-amino-2-hydroxyiminoethyl]piperidin-4-yl]-3-chlorothiophene-2-carboxamide
CID 80641295

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide (CID 104978488) is 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide is NC(CN1CCC(NS(=O)(=O)NC2CC2)CC1)=NO.
What is the InChIKey of 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide?
The InChIKey is WNKQDTTWGFZBNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5O3S/c11-10(12-16)7-15-5-3-9(4-6-15)14-19(17,18)13-8-1-2-8/h8-9,13-14,16H,1-7H2,(H2,11,12).
What are the key properties of 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide?
2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide has a molecular weight of 291.38 g/mol, XLogP of -1.22, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopropylsulfamoylamino)piperidin-1-yl]-N'-hydroxyethanimidamide is sourced from PubChem (CID 104978488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).