N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide

C14H26N2O3 — CID 119574453

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide
SMILESCC(OCC1CCCO1)C(=O)NC(C)(CN)C1CC1
InChIInChI=1S/C14H26N2O3/c1-10(19-8-12-4-3-7-18-12)13(17)16-14(2,9-15)11-5-6-11/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyOJVKEEURGVXPAT-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.81
Rot. Bonds7

About N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide

N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide (PubChem CID 119574453) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide
PubChem CID119574453
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide
SMILESCC(OCC1CCCO1)C(=O)NC(C)(CN)C1CC1
InChIInChI=1S/C14H26N2O3/c1-10(19-8-12-4-3-7-18-12)13(17)16-14(2,9-15)11-5-6-11/h10-12H,3-9,15H2,1-2H3,(H,16,17)
InChIKeyOJVKEEURGVXPAT-UHFFFAOYSA-N
XLogP0.81
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-(oxan-2-ylmethoxy)propanamide;hydrochloride
CID 119525083
2-methyl-2-[[(2S)-2-[[(2R)-oxan-2-yl]methoxy]propanoyl]amino]propanoic acid
CID 125152183
N-(3-amino-2-methylpropyl)-2-(oxolan-2-ylmethoxy)propanamide;hydrochloride
CID 119996178
N-[2-(aminomethyl)cyclopentyl]-2-(oxan-2-ylmethoxy)propanamide
CID 119605197
2-cyclopropyl-2-N-(oxolan-2-ylmethyl)propane-1,2-diamine
CID 65377354
2-[2-(oxolan-2-ylmethoxy)propanoylamino]butanoic acid
CID 119224066
4-[[(2R)-2-[[(2R)-oxolan-2-yl]methoxy]propanoyl]amino]benzoic acid
CID 97233672
N-(4-fluorophenoxy)-2-(oxolan-2-ylmethoxy)propanamide
CID 126834949
(2S)-2-[[(2R)-oxolan-2-yl]methoxy]-N-[1-(trifluoromethyl)cyclohexyl]propanamide
CID 124884665
2-(oxolan-2-ylmethoxy)-N-(piperidin-3-ylmethyl)propanamide
CID 119462659
N-(1-amino-2,3-dimethylbutan-2-yl)-3-(oxolan-2-ylmethoxy)propanamide
CID 119605686
N-(5-tert-butyl-2-hydroxyphenyl)-2-(oxolan-2-ylmethoxy)propanamide
CID 51126483

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide (CID 119574453) is N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide is CC(OCC1CCCO1)C(=O)NC(C)(CN)C1CC1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide?
The InChIKey is OJVKEEURGVXPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10(19-8-12-4-3-7-18-12)13(17)16-14(2,9-15)11-5-6-11/h10-12H,3-9,15H2,1-2H3,(H,16,17).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide has a molecular weight of 270.37 g/mol, XLogP of 0.81, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-2-(oxolan-2-ylmethoxy)propanamide is sourced from PubChem (CID 119574453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).