N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide

C12H22N4O2 — CID 79163675

IUPACN'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide
SMILESCC1CCN(C(=O)N2CCCC2C(N)=NO)CC1
InChIInChI=1S/C12H22N4O2/c1-9-4-7-15(8-5-9)12(17)16-6-2-3-10(16)11(13)14-18/h9-10,18H,2-8H2,1H3,(H2,13,14)
InChIKeyUVAWXUZFJDYDIU-UHFFFAOYSA-N
MW254.33 g/mol
LogP1.05
Rot. Bonds1

About N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide

N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide (PubChem CID 79163675) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide
PubChem CID79163675
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide
SMILESCC1CCN(C(=O)N2CCCC2C(N)=NO)CC1
InChIInChI=1S/C12H22N4O2/c1-9-4-7-15(8-5-9)12(17)16-6-2-3-10(16)11(13)14-18/h9-10,18H,2-8H2,1H3,(H2,13,14)
InChIKeyUVAWXUZFJDYDIU-UHFFFAOYSA-N
XLogP1.05
TPSA82.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide 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

1-(4-methylazepane-1-carbonyl)pyrrolidine-2-carboxylic acid
CID 63627584
(2S)-2-(N'-hydroxycarbamimidoyl)pyrrolidine-1-carboxylic acid
CID 173144791
N'-hydroxy-1-propanoylpyrrolidine-2-carboximidamide
CID 77036368
N-methyl-1-(4-methylpiperidine-1-carbonyl)piperidine-2-carboxamide
CID 116654881
N'-hydroxy-1-(2-methoxyacetyl)pyrrolidine-2-carboximidamide
CID 77035994
(2S)-2-[(Z)-N'-hydroxycarbamimidoyl]piperidine-1-carboxylic acid
CID 21355915
4-methyl-1-(4-methylazepane-1-carbonyl)piperidine-2-carboxylic acid
CID 114425581
N'-hydroxy-1-(3-methoxypropanoyl)pyrrolidine-2-carboximidamide
CID 77036476
N'-hydroxy-1-pentanoylpyrrolidine-2-carboximidamide
CID 77036233
N'-hydroxy-1-(4-methylpentanoyl)pyrrolidine-2-carboximidamide
CID 77036265
N'-hydroxy-1-(2-methylsulfonylpropanoyl)pyrrolidine-2-carboximidamide
CID 104521804
1-(4-methylpiperidine-1-carbonyl)piperidine-4-carboxamide
CID 115575168

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide?
The IUPAC name of N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide (CID 79163675) is N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide is CC1CCN(C(=O)N2CCCC2C(N)=NO)CC1.
What is the InChIKey of N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide?
The InChIKey is UVAWXUZFJDYDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-9-4-7-15(8-5-9)12(17)16-6-2-3-10(16)11(13)14-18/h9-10,18H,2-8H2,1H3,(H2,13,14).
What are the key properties of N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide?
N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide has a molecular weight of 254.33 g/mol, XLogP of 1.05, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-1-(4-methylpiperidine-1-carbonyl)pyrrolidine-2-carboximidamide is sourced from PubChem (CID 79163675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).