4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide

C12H23N3O2 — CID 66238269

IUPAC4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide
SMILESCCN1CCC(NC(=O)C2COCC2N)CC1
InChIInChI=1S/C12H23N3O2/c1-2-15-5-3-9(4-6-15)14-12(16)10-7-17-8-11(10)13/h9-11H,2-8,13H2,1H3,(H,14,16)
InChIKeyULGYMUDGCMYJLB-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.44
Rot. Bonds3

About 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide

4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide (PubChem CID 66238269) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide
PubChem CID66238269
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide
SMILESCCN1CCC(NC(=O)C2COCC2N)CC1
InChIInChI=1S/C12H23N3O2/c1-2-15-5-3-9(4-6-15)14-12(16)10-7-17-8-11(10)13/h9-11H,2-8,13H2,1H3,(H,14,16)
InChIKeyULGYMUDGCMYJLB-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]oxolane-3-carboxamide
CID 66240226
2-amino-N-(1-ethylpiperidin-4-yl)cyclopentane-1-carboxamide
CID 64824596
4-amino-N-cycloheptyloxolane-3-carboxamide
CID 66240800
N-(1-ethylpiperidin-4-yl)-4-methylpyrrolidine-3-carboxamide
CID 63715986
2-amino-N-(1-propylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62777037
(1-ethylpiperidin-4-yl)carbamic acid;hydrochloride
CID 68989076
2-amino-N-(1-ethylpiperidin-4-yl)-2-methylpropanamide
CID 61266826
methyl N-(1-ethylazepan-4-yl)carbamate
CID 166167554
3-[(1-ethylpiperidin-4-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 61039761
(2R)-N-(1-ethylpiperidin-4-yl)pyrrolidine-2-carboxamide
CID 93469163
N-(1-ethylpiperidin-4-yl)hydroxylamine
CID 82685178
1-(4-aminooxolane-3-carbonyl)-N-ethylpiperidine-4-carboxamide
CID 66235835

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide (CID 66238269) is 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide is CCN1CCC(NC(=O)C2COCC2N)CC1.
What is the InChIKey of 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide?
The InChIKey is ULGYMUDGCMYJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-2-15-5-3-9(4-6-15)14-12(16)10-7-17-8-11(10)13/h9-11H,2-8,13H2,1H3,(H,14,16).
What are the key properties of 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide?
4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethylpiperidin-4-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66238269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).