1-ethyl-N-hydroxypiperidine-3-carboxamide

C8H16N2O2 — CID 57080127

IUPAC1-ethyl-N-hydroxypiperidine-3-carboxamide
SMILESCCN1CCCC(C(=O)NO)C1
InChIInChI=1S/C8H16N2O2/c1-2-10-5-3-4-7(6-10)8(11)9-12/h7,12H,2-6H2,1H3,(H,9,11)
InChIKeyGNMINLKYJCTWSS-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.22
Rot. Bonds2

About 1-ethyl-N-hydroxypiperidine-3-carboxamide

1-ethyl-N-hydroxypiperidine-3-carboxamide (PubChem CID 57080127) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 1-ethyl-N-hydroxypiperidine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-hydroxypiperidine-3-carboxamide
PubChem CID57080127
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name1-ethyl-N-hydroxypiperidine-3-carboxamide
SMILESCCN1CCCC(C(=O)NO)C1
InChIInChI=1S/C8H16N2O2/c1-2-10-5-3-4-7(6-10)8(11)9-12/h7,12H,2-6H2,1H3,(H,9,11)
InChIKeyGNMINLKYJCTWSS-UHFFFAOYSA-N
XLogP0.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-ethylpiperidine-3-carbohydrazide
CID 68651092
1-butyl-N-propylpiperidine-3-carboxamide
CID 60606926
(3S)-1-ethyl-N-[3-(2H-tetrazol-5-yl)propyl]piperidine-3-carboxamide
CID 126442269
1-ethyl-N-[2-(1H-imidazol-2-yl)ethyl]piperidine-3-carboxamide
CID 119073659
1-cyclopentyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589989
1-cyclopropyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589816
1-(2-methoxyethyl)-N-methylpiperidine-3-carboxamide
CID 143767660
1-ethyl-N-[2-methoxy-5-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 54007816
(3S)-1-[2-(1,3-dioxolan-2-yl)ethyl]-N-ethylpiperidine-3-carboxamide
CID 99604716
N-ethyl-1-propanoylpiperidine-3-carboxamide
CID 68576487
3-amino-N-(1-ethylpiperidin-3-yl)cyclopentane-1-carboxamide;dihydrochloride
CID 119862380
1-[(2-ethylphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 136534264

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-hydroxypiperidine-3-carboxamide?
The IUPAC name of 1-ethyl-N-hydroxypiperidine-3-carboxamide (CID 57080127) is 1-ethyl-N-hydroxypiperidine-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-hydroxypiperidine-3-carboxamide?
The canonical SMILES for 1-ethyl-N-hydroxypiperidine-3-carboxamide is CCN1CCCC(C(=O)NO)C1.
What is the InChIKey of 1-ethyl-N-hydroxypiperidine-3-carboxamide?
The InChIKey is GNMINLKYJCTWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-10-5-3-4-7(6-10)8(11)9-12/h7,12H,2-6H2,1H3,(H,9,11).
What are the key properties of 1-ethyl-N-hydroxypiperidine-3-carboxamide?
1-ethyl-N-hydroxypiperidine-3-carboxamide has a molecular weight of 172.23 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-hydroxypiperidine-3-carboxamide is sourced from PubChem (CID 57080127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).