4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide

C10H19N3O3 — CID 66250212

IUPAC4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide
SMILESCCNC(=O)CNC(=O)C1(C)COCC1N
InChIInChI=1S/C10H19N3O3/c1-3-12-8(14)4-13-9(15)10(2)6-16-5-7(10)11/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyQNKIGRPMFQWLCW-UHFFFAOYSA-N
MW229.28 g/mol
LogP-1.40
Rot. Bonds4

About 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide

4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide (PubChem CID 66250212) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide
PubChem CID66250212
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide
SMILESCCNC(=O)CNC(=O)C1(C)COCC1N
InChIInChI=1S/C10H19N3O3/c1-3-12-8(14)4-13-9(15)10(2)6-16-5-7(10)11/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15)
InChIKeyQNKIGRPMFQWLCW-UHFFFAOYSA-N
XLogP-1.40
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-1.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide (CID 66250212) is 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide is CCNC(=O)CNC(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide?
The InChIKey is QNKIGRPMFQWLCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-3-12-8(14)4-13-9(15)10(2)6-16-5-7(10)11/h7H,3-6,11H2,1-2H3,(H,12,14)(H,13,15).
What are the key properties of 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide?
4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide has a molecular weight of 229.28 g/mol, XLogP of -1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(ethylamino)-2-oxoethyl]-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66250212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).