propan-2-yl 4-(ethylamino)oxolane-3-carboxylate

C10H19NO3 — CID 66247148

IUPACpropan-2-yl 4-(ethylamino)oxolane-3-carboxylate
SMILESCCNC1COCC1C(=O)OC(C)C
InChIInChI=1S/C10H19NO3/c1-4-11-9-6-13-5-8(9)10(12)14-7(2)3/h7-9,11H,4-6H2,1-3H3
InChIKeyPZXFRQMOWBMTFR-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.56
Rot. Bonds4

About propan-2-yl 4-(ethylamino)oxolane-3-carboxylate

propan-2-yl 4-(ethylamino)oxolane-3-carboxylate (PubChem CID 66247148) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is propan-2-yl 4-(ethylamino)oxolane-3-carboxylate.

Molecular Properties

Compound Namepropan-2-yl 4-(ethylamino)oxolane-3-carboxylate
PubChem CID66247148
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Namepropan-2-yl 4-(ethylamino)oxolane-3-carboxylate
SMILESCCNC1COCC1C(=O)OC(C)C
InChIInChI=1S/C10H19NO3/c1-4-11-9-6-13-5-8(9)10(12)14-7(2)3/h7-9,11H,4-6H2,1-3H3
InChIKeyPZXFRQMOWBMTFR-UHFFFAOYSA-N
XLogP0.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze propan-2-yl 4-(ethylamino)oxolane-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(ethylamino)oxolan-3-yl]-3-methylbutan-1-one
CID 116587978
2-ethyl-1-[4-(ethylamino)oxolan-3-yl]butan-1-one
CID 116588173
butan-2-yl 4-(methylamino)oxolane-3-carboxylate
CID 66267071
[4-(ethylamino)oxolan-3-yl]-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103495367
N-[(1R)-1-cyclopentylethyl]-4-(ethylamino)oxolane-3-carboxamide
CID 81391586
N-(2-cyclopropylpropyl)-4-(ethylamino)oxolane-3-carboxamide
CID 113475270
2-[(2-methylpropan-2-yl)oxy]ethyl 4-(ethylamino)oxolane-3-carboxylate
CID 112588000
1-[4-(ethylamino)oxolan-3-yl]-3-methylhexan-1-one
CID 116588055
4-(ethylamino)-N-(4-hydroxybutan-2-yl)oxolane-3-carboxamide
CID 83177200
4-(ethylamino)-N-(1-methylsulfonylpropan-2-yl)oxolane-3-carboxamide
CID 66259891
[4-(ethylamino)oxolan-3-yl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 106835851
methyl 4-(propylamino)oxolane-3-carboxylate
CID 66252301

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 4-(ethylamino)oxolane-3-carboxylate?
The IUPAC name of propan-2-yl 4-(ethylamino)oxolane-3-carboxylate (CID 66247148) is propan-2-yl 4-(ethylamino)oxolane-3-carboxylate.
What is the SMILES notation for propan-2-yl 4-(ethylamino)oxolane-3-carboxylate?
The canonical SMILES for propan-2-yl 4-(ethylamino)oxolane-3-carboxylate is CCNC1COCC1C(=O)OC(C)C.
What is the InChIKey of propan-2-yl 4-(ethylamino)oxolane-3-carboxylate?
The InChIKey is PZXFRQMOWBMTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-11-9-6-13-5-8(9)10(12)14-7(2)3/h7-9,11H,4-6H2,1-3H3.
What are the key properties of propan-2-yl 4-(ethylamino)oxolane-3-carboxylate?
propan-2-yl 4-(ethylamino)oxolane-3-carboxylate has a molecular weight of 201.27 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 4-(ethylamino)oxolane-3-carboxylate is sourced from PubChem (CID 66247148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).