4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide

C14H27N3O2 — CID 66260386

IUPAC4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NCC1CCCN1CC
InChIInChI=1S/C14H27N3O2/c1-3-15-13-10-19-9-12(13)14(18)16-8-11-6-5-7-17(11)4-2/h11-13,15H,3-10H2,1-2H3,(H,16,18)
InChIKeyOWXDFZSGLGZMRV-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.21
Rot. Bonds6

About 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide

4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide (PubChem CID 66260386) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide
PubChem CID66260386
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NCC1CCCN1CC
InChIInChI=1S/C14H27N3O2/c1-3-15-13-10-19-9-12(13)14(18)16-8-11-6-5-7-17(11)4-2/h11-13,15H,3-10H2,1-2H3,(H,16,18)
InChIKeyOWXDFZSGLGZMRV-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide (CID 66260386) is 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide is CCNC1COCC1C(=O)NCC1CCCN1CC.
What is the InChIKey of 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide?
The InChIKey is OWXDFZSGLGZMRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-15-13-10-19-9-12(13)14(18)16-8-11-6-5-7-17(11)4-2/h11-13,15H,3-10H2,1-2H3,(H,16,18).
What are the key properties of 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide?
4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]oxolane-3-carboxamide is sourced from PubChem (CID 66260386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).