N-ethoxypiperidine-4-carboxamide

C8H16N2O2 — CID 64974737

IUPACN-ethoxypiperidine-4-carboxamide
SMILESCCONC(=O)C1CCNCC1
InChIInChI=1S/C8H16N2O2/c1-2-12-10-8(11)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyVHHZDTTYWGYJPZ-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.05
Rot. Bonds3

About N-ethoxypiperidine-4-carboxamide

N-ethoxypiperidine-4-carboxamide (PubChem CID 64974737) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-ethoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-ethoxypiperidine-4-carboxamide
PubChem CID64974737
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-ethoxypiperidine-4-carboxamide
SMILESCCONC(=O)C1CCNCC1
InChIInChI=1S/C8H16N2O2/c1-2-12-10-8(11)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyVHHZDTTYWGYJPZ-UHFFFAOYSA-N
XLogP0.05
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethoxypyrrolidine-3-carboxamide
CID 64974765
ethyl 2-methyl-3-(piperidine-4-carbonylamino)propanoate
CID 119326846
ethyl 4-(piperidine-4-carbonylamino)piperidine-1-carboxylate
CID 24699538
N-(aminomethyl)piperidine-4-carboxamide;ethane
CID 167467064
N'-propanoylpiperidine-4-carbohydrazide
CID 82112301
N-ethoxy-3,3-difluorocyclohexane-1-carboxamide
CID 130487784
propan-2-yl 2-methyl-3-(piperidine-4-carbonylamino)propanoate
CID 119338456
N-(5-methylhexan-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119263583
N-(2-ethylbutyl)piperidine-4-carboxamide
CID 115733723
methyl 3-ethyl-3-(piperidine-4-carbonylamino)pentanoate;hydrochloride
CID 119344214
N-ethoxy-2-methyloxane-4-carboxamide
CID 131133773
ethyl (3R)-pyrrolidine-3-carboxylate
CID 53488454

Frequently Asked Questions

What is the IUPAC name of N-ethoxypiperidine-4-carboxamide?
The IUPAC name of N-ethoxypiperidine-4-carboxamide (CID 64974737) is N-ethoxypiperidine-4-carboxamide.
What is the SMILES notation for N-ethoxypiperidine-4-carboxamide?
The canonical SMILES for N-ethoxypiperidine-4-carboxamide is CCONC(=O)C1CCNCC1.
What is the InChIKey of N-ethoxypiperidine-4-carboxamide?
The InChIKey is VHHZDTTYWGYJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-12-10-8(11)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3,(H,10,11).
What are the key properties of N-ethoxypiperidine-4-carboxamide?
N-ethoxypiperidine-4-carboxamide has a molecular weight of 172.23 g/mol, XLogP of 0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxypiperidine-4-carboxamide is sourced from PubChem (CID 64974737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).