N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide

C9H18N2O2 — CID 104873146

IUPACN-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide
SMILESC[C@H](CN)NC(=O)C1CCCOC1
InChIInChI=1S/C9H18N2O2/c1-7(5-10)11-9(12)8-3-2-4-13-6-8/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8?/m1/s1
InChIKeyYGMVRLMUOZEWNM-GVHYBUMESA-N
MW186.25 g/mol
LogP-0.12
Rot. Bonds3

About N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide

N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide (PubChem CID 104873146) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide
PubChem CID104873146
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide
SMILESC[C@H](CN)NC(=O)C1CCCOC1
InChIInChI=1S/C9H18N2O2/c1-7(5-10)11-9(12)8-3-2-4-13-6-8/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8?/m1/s1
InChIKeyYGMVRLMUOZEWNM-GVHYBUMESA-N
XLogP-0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-[(1-ethylcyclopropyl)methyl]oxane-3-carboxamide
CID 99775524
N-[1-[cyclopropyl(oxane-3-carbonyl)amino]-2-methylpropan-2-yl]oxane-3-carboxamide
CID 127907795
3-Methyl-4-(2-methyloxane-3-carbonyl)piperazin-2-one
CID 136535585
N-(1,1,1-trifluoro-3,3-dimethylbutan-2-yl)oxane-3-carboxamide
CID 71986117
N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]oxane-3-carboxamide
CID 72000625
N-[6-(trifluoromethyl)piperidin-3-yl]oxane-3-carboxamide
CID 82811551
(3R)-N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]oxane-3-carboxamide
CID 97571587
(3S)-N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]oxane-3-carboxamide
CID 97571588
(3R)-N-[(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-yl]oxane-3-carboxamide
CID 97586054
(3R)-N-[(2R)-1,1,1-trifluoro-3,3-dimethylbutan-2-yl]oxane-3-carboxamide
CID 97586055
(3S)-N-[(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-yl]oxane-3-carboxamide
CID 97586056
(3S)-N-[(2R)-1,1,1-trifluoro-3,3-dimethylbutan-2-yl]oxane-3-carboxamide
CID 97586057

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide (CID 104873146) is N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide is C[C@H](CN)NC(=O)C1CCCOC1.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide?
The InChIKey is YGMVRLMUOZEWNM-GVHYBUMESA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(5-10)11-9(12)8-3-2-4-13-6-8/h7-8H,2-6,10H2,1H3,(H,11,12)/t7-,8?/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide?
N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide has a molecular weight of 186.25 g/mol, XLogP of -0.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide is sourced from PubChem (CID 104873146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).