4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide

C11H22N2O3 — CID 66257493

IUPAC4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NC(CC)CO
InChIInChI=1S/C11H22N2O3/c1-3-8(5-14)13-11(15)9-6-16-7-10(9)12-4-2/h8-10,12,14H,3-7H2,1-2H3,(H,13,15)
InChIKeyKOGVQSKWAPHQMA-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.50
Rot. Bonds6

About 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide

4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide (PubChem CID 66257493) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
PubChem CID66257493
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)NC(CC)CO
InChIInChI=1S/C11H22N2O3/c1-3-8(5-14)13-11(15)9-6-16-7-10(9)12-4-2/h8-10,12,14H,3-7H2,1-2H3,(H,13,15)
InChIKeyKOGVQSKWAPHQMA-UHFFFAOYSA-N
XLogP-0.50
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide (CID 66257493) is 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide is CCNC1COCC1C(=O)NC(CC)CO.
What is the InChIKey of 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide?
The InChIKey is KOGVQSKWAPHQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-3-8(5-14)13-11(15)9-6-16-7-10(9)12-4-2/h8-10,12,14H,3-7H2,1-2H3,(H,13,15).
What are the key properties of 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide?
4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide has a molecular weight of 230.31 g/mol, XLogP of -0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66257493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).