4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide

C15H22N4O3 — CID 11849007

IUPAC4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(CCCC1CCN(C(=O)Nc2cccnc2)CC1)NO
InChIInChI=1S/C15H22N4O3/c20-14(18-22)5-1-3-12-6-9-19(10-7-12)15(21)17-13-4-2-8-16-11-13/h2,4,8,11-12,22H,1,3,5-7,9-10H2,(H,17,21)(H,18,20)
InChIKeyBEOVAEFIYMOMRV-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.00
Rot. Bonds5

About 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide

4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 11849007) has the molecular formula C15H22N4O3 and a molecular weight of 306.37 g/mol. Its IUPAC name is 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide
PubChem CID11849007
Molecular FormulaC15H22N4O3
Molecular Weight306.37 g/mol
Exact Mass306.17
IUPAC Name4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(CCCC1CCN(C(=O)Nc2cccnc2)CC1)NO
InChIInChI=1S/C15H22N4O3/c20-14(18-22)5-1-3-12-6-9-19(10-7-12)15(21)17-13-4-2-8-16-11-13/h2,4,8,11-12,22H,1,3,5-7,9-10H2,(H,17,21)(H,18,20)
InChIKeyBEOVAEFIYMOMRV-UHFFFAOYSA-N
XLogP2.00
TPSA94.56 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide 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-(4-aminophenyl)-4-[4-(hydroxyamino)-4-oxobutyl]piperidine-1-carboxamide
CID 91356315
4-[4-(hydroxyamino)-4-oxobutyl]-N-(4-pyridin-2-ylphenyl)piperidine-1-carboxamide
CID 91320954
N-[4-[2-(diethylamino)ethyl]phenyl]-4-[4-(hydroxyamino)-4-oxobutyl]piperidine-1-carboxamide
CID 11848263
N-[4-(3,5-dimethyl-1H-pyrazol-4-yl)phenyl]-4-[4-(hydroxyamino)-4-oxobutyl]piperidine-1-carboxamide
CID 142691662
4-formyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 110706402
3-(cyclopropylmethoxy)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 119105538
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 3370606
N-hydroxy-4-[1-(2-phenylacetyl)piperidin-4-yl]butanamide
CID 52918058
N-(3-chlorophenyl)-4-(2-pyridin-3-yloxyethyl)piperidine-1-carboxamide
CID 53151028
4-[4-(2-cyclohexylethylamino)benzoyl]-N-pyridin-3-ylpiperazine-1-carboxamide
CID 70997266
4-(bromomethylidene)-N-pyridin-3-ylpiperidine-1-carboxamide
CID 66883942
4-[4-(hydroxyamino)-4-oxobutyl]-N-(2H-pyrimidin-1-yl)piperidine-1-carboxamide
CID 141152827

Frequently Asked Questions

What is the IUPAC name of 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide (CID 11849007) is 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide is O=C(CCCC1CCN(C(=O)Nc2cccnc2)CC1)NO.
What is the InChIKey of 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is BEOVAEFIYMOMRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3/c20-14(18-22)5-1-3-12-6-9-19(10-7-12)15(21)17-13-4-2-8-16-11-13/h2,4,8,11-12,22H,1,3,5-7,9-10H2,(H,17,21)(H,18,20).
What are the key properties of 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide?
4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 2.00, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(hydroxyamino)-4-oxobutyl]-N-pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 11849007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).