4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide

C11H23N3O2 — CID 66264175

IUPAC4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide
SMILESCCN(C)CCNC(=O)C1(C)COCC1N
InChIInChI=1S/C11H23N3O2/c1-4-14(3)6-5-13-10(15)11(2)8-16-7-9(11)12/h9H,4-8,12H2,1-3H3,(H,13,15)
InChIKeyXXPMJNCANWSIND-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.58
Rot. Bonds5

About 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide

4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide (PubChem CID 66264175) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide
PubChem CID66264175
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide
SMILESCCN(C)CCNC(=O)C1(C)COCC1N
InChIInChI=1S/C11H23N3O2/c1-4-14(3)6-5-13-10(15)11(2)8-16-7-9(11)12/h9H,4-8,12H2,1-3H3,(H,13,15)
InChIKeyXXPMJNCANWSIND-UHFFFAOYSA-N
XLogP-0.58
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide (CID 66264175) is 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide is CCN(C)CCNC(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide?
The InChIKey is XXPMJNCANWSIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-4-14(3)6-5-13-10(15)11(2)8-16-7-9(11)12/h9H,4-8,12H2,1-3H3,(H,13,15).
What are the key properties of 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide?
4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide has a molecular weight of 229.32 g/mol, XLogP of -0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[ethyl(methyl)amino]ethyl]-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66264175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).