3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide

C11H20N2O3 — CID 64891805

IUPAC3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide
SMILESNC1(C(=O)NC2(CO)CCCC2)CCOC1
InChIInChI=1S/C11H20N2O3/c12-11(5-6-16-8-11)9(15)13-10(7-14)3-1-2-4-10/h14H,1-8,12H2,(H,13,15)
InChIKeyZENHOKPGVYSDNP-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.47
Rot. Bonds3

About 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide

3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide (PubChem CID 64891805) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide
PubChem CID64891805
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide
SMILESNC1(C(=O)NC2(CO)CCCC2)CCOC1
InChIInChI=1S/C11H20N2O3/c12-11(5-6-16-8-11)9(15)13-10(7-14)3-1-2-4-10/h14H,1-8,12H2,(H,13,15)
InChIKeyZENHOKPGVYSDNP-UHFFFAOYSA-N
XLogP-0.47
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide (CID 64891805) is 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide is NC1(C(=O)NC2(CO)CCCC2)CCOC1.
What is the InChIKey of 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide?
The InChIKey is ZENHOKPGVYSDNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c12-11(5-6-16-8-11)9(15)13-10(7-14)3-1-2-4-10/h14H,1-8,12H2,(H,13,15).
What are the key properties of 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide?
3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide has a molecular weight of 228.29 g/mol, XLogP of -0.47, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(hydroxymethyl)cyclopentyl]oxolane-3-carboxamide is sourced from PubChem (CID 64891805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).