N-(1-aminopentan-2-yl)oxane-3-carboxamide

C11H22N2O2 — CID 65191424

IUPACN-(1-aminopentan-2-yl)oxane-3-carboxamide
SMILESCCCC(CN)NC(=O)C1CCCOC1
InChIInChI=1S/C11H22N2O2/c1-2-4-10(7-12)13-11(14)9-5-3-6-15-8-9/h9-10H,2-8,12H2,1H3,(H,13,14)
InChIKeyLKRFKOWVNPJEIH-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.66
Rot. Bonds5

About N-(1-aminopentan-2-yl)oxane-3-carboxamide

N-(1-aminopentan-2-yl)oxane-3-carboxamide (PubChem CID 65191424) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(1-aminopentan-2-yl)oxane-3-carboxamide.

Molecular Properties

Compound NameN-(1-aminopentan-2-yl)oxane-3-carboxamide
PubChem CID65191424
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(1-aminopentan-2-yl)oxane-3-carboxamide
SMILESCCCC(CN)NC(=O)C1CCCOC1
InChIInChI=1S/C11H22N2O2/c1-2-4-10(7-12)13-11(14)9-5-3-6-15-8-9/h9-10H,2-8,12H2,1H3,(H,13,14)
InChIKeyLKRFKOWVNPJEIH-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide
CID 104873146
N-(1-aminohexan-2-yl)cyclohexanecarboxamide
CID 80697500
N-(3-amino-2-methylpropyl)oxane-3-carboxamide
CID 63011321
N-[2-(2-methylpentanoylamino)ethyl]oxane-3-carboxamide
CID 154759417
3-(oxane-3-carbonylamino)butanoic acid
CID 62759193
N-(5-amino-4-methylpentyl)oxane-3-carboxamide
CID 106153124
N-[(3S)-hexan-3-yl]oxane-4-carboxamide
CID 170970278
2-hydroxy-1-(oxan-3-yl)pentan-1-one
CID 107136058
N-(1-hydroxypentan-3-yl)oxolane-3-carboxamide
CID 115735205
N-(1-aminobutan-2-yl)cyclooctanecarboxamide
CID 65020917
N-hex-1-yn-3-yloxolane-3-carboxamide
CID 103528440
3-methyl-2-(oxane-3-carbonylamino)butanoic acid
CID 62758810

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-2-yl)oxane-3-carboxamide?
The IUPAC name of N-(1-aminopentan-2-yl)oxane-3-carboxamide (CID 65191424) is N-(1-aminopentan-2-yl)oxane-3-carboxamide.
What is the SMILES notation for N-(1-aminopentan-2-yl)oxane-3-carboxamide?
The canonical SMILES for N-(1-aminopentan-2-yl)oxane-3-carboxamide is CCCC(CN)NC(=O)C1CCCOC1.
What is the InChIKey of N-(1-aminopentan-2-yl)oxane-3-carboxamide?
The InChIKey is LKRFKOWVNPJEIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-2-4-10(7-12)13-11(14)9-5-3-6-15-8-9/h9-10H,2-8,12H2,1H3,(H,13,14).
What are the key properties of N-(1-aminopentan-2-yl)oxane-3-carboxamide?
N-(1-aminopentan-2-yl)oxane-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-2-yl)oxane-3-carboxamide is sourced from PubChem (CID 65191424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).