N-[2-(propylamino)ethyl]oxolane-2-carboxamide

C10H20N2O2 — CID 62658997

IUPACN-[2-(propylamino)ethyl]oxolane-2-carboxamide
SMILESCCCNCCNC(=O)C1CCCO1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-6-7-12-10(13)9-4-3-8-14-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyKKELUIVTJYCTGF-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.28
Rot. Bonds6

About N-[2-(propylamino)ethyl]oxolane-2-carboxamide

N-[2-(propylamino)ethyl]oxolane-2-carboxamide (PubChem CID 62658997) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-[2-(propylamino)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(propylamino)ethyl]oxolane-2-carboxamide
PubChem CID62658997
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-[2-(propylamino)ethyl]oxolane-2-carboxamide
SMILESCCCNCCNC(=O)C1CCCO1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-6-7-12-10(13)9-4-3-8-14-9/h9,11H,2-8H2,1H3,(H,12,13)
InChIKeyKKELUIVTJYCTGF-UHFFFAOYSA-N
XLogP0.28
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-methoxyethylamino)ethyl]oxolane-2-carboxamide
CID 82993664
(2R)-N-pentyloxolane-2-carboxamide
CID 146504537
N-[2-(propylamino)ethyl]-1,4-dioxane-2-carboxamide
CID 62657483
N-(2-methoxyethyl)oxolane-2-carboxamide
CID 4190232
N-[2-[(3-chloro-2,2-dimethylpropanoyl)amino]ethyl]oxolane-2-carboxamide
CID 108573698
2-(propylamino)ethyl oxolane-2-carboxylate
CID 82532815
3-(propylamino)propyl oxolane-2-carboxylate
CID 82532736
(2R)-N-but-3-enyloxolane-2-carboxamide
CID 104861411
N-[4-(propylamino)cyclohexyl]oxolane-2-carboxamide
CID 43653441
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]oxolane-2-carboxamide
CID 110423404
ethyl 4-[[(2S)-oxolane-2-carbonyl]amino]butanoate
CID 103872319
(2S)-N-[2-[[(2R)-butan-2-yl]-methylamino]ethyl]oxolane-2-carboxamide
CID 95167848

Frequently Asked Questions

What is the IUPAC name of N-[2-(propylamino)ethyl]oxolane-2-carboxamide?
The IUPAC name of N-[2-(propylamino)ethyl]oxolane-2-carboxamide (CID 62658997) is N-[2-(propylamino)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[2-(propylamino)ethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[2-(propylamino)ethyl]oxolane-2-carboxamide is CCCNCCNC(=O)C1CCCO1.
What is the InChIKey of N-[2-(propylamino)ethyl]oxolane-2-carboxamide?
The InChIKey is KKELUIVTJYCTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-5-11-6-7-12-10(13)9-4-3-8-14-9/h9,11H,2-8H2,1H3,(H,12,13).
What are the key properties of N-[2-(propylamino)ethyl]oxolane-2-carboxamide?
N-[2-(propylamino)ethyl]oxolane-2-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(propylamino)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 62658997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).