N-(2-aminocyclopropyl)oxane-2-carboxamide

C9H16N2O2 — CID 62214437

IUPACN-(2-aminocyclopropyl)oxane-2-carboxamide
SMILESNC1CC1NC(=O)C1CCCCO1
InChIInChI=1S/C9H16N2O2/c10-6-5-7(6)11-9(12)8-3-1-2-4-13-8/h6-8H,1-5,10H2,(H,11,12)
InChIKeyDTAHNQWKWGNWGO-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.23
Rot. Bonds2

About N-(2-aminocyclopropyl)oxane-2-carboxamide

N-(2-aminocyclopropyl)oxane-2-carboxamide (PubChem CID 62214437) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2-aminocyclopropyl)oxane-2-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclopropyl)oxane-2-carboxamide
PubChem CID62214437
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2-aminocyclopropyl)oxane-2-carboxamide
SMILESNC1CC1NC(=O)C1CCCCO1
InChIInChI=1S/C9H16N2O2/c10-6-5-7(6)11-9(12)8-3-1-2-4-13-8/h6-8H,1-5,10H2,(H,11,12)
InChIKeyDTAHNQWKWGNWGO-UHFFFAOYSA-N
XLogP-0.23
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopropyl)oxane-2-carboxamide?
The IUPAC name of N-(2-aminocyclopropyl)oxane-2-carboxamide (CID 62214437) is N-(2-aminocyclopropyl)oxane-2-carboxamide.
What is the SMILES notation for N-(2-aminocyclopropyl)oxane-2-carboxamide?
The canonical SMILES for N-(2-aminocyclopropyl)oxane-2-carboxamide is NC1CC1NC(=O)C1CCCCO1.
What is the InChIKey of N-(2-aminocyclopropyl)oxane-2-carboxamide?
The InChIKey is DTAHNQWKWGNWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c10-6-5-7(6)11-9(12)8-3-1-2-4-13-8/h6-8H,1-5,10H2,(H,11,12).
What are the key properties of N-(2-aminocyclopropyl)oxane-2-carboxamide?
N-(2-aminocyclopropyl)oxane-2-carboxamide has a molecular weight of 184.24 g/mol, XLogP of -0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopropyl)oxane-2-carboxamide is sourced from PubChem (CID 62214437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).