4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide

C10H20N2O3 — CID 66237512

IUPAC4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide
SMILESCOCCC(C)NC(=O)C1COCC1N
InChIInChI=1S/C10H20N2O3/c1-7(3-4-14-2)12-10(13)8-5-15-6-9(8)11/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyZJLSWTMXLYWJHA-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.50
Rot. Bonds5

About 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide

4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide (PubChem CID 66237512) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide
PubChem CID66237512
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide
SMILESCOCCC(C)NC(=O)C1COCC1N
InChIInChI=1S/C10H20N2O3/c1-7(3-4-14-2)12-10(13)8-5-15-6-9(8)11/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyZJLSWTMXLYWJHA-UHFFFAOYSA-N
XLogP-0.50
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(4-methoxybutan-2-yl)cyclohexane-1-carboxamide
CID 64603110
4-amino-N-[1-(diethylamino)propan-2-yl]oxolane-3-carboxamide
CID 66237288
4-amino-N-(1-phenylpropan-2-yl)oxolane-3-carboxamide
CID 66235478
5-amino-N-(4-methoxybutan-2-yl)-2-methylcyclohexane-1-carboxamide
CID 64603308
2-amino-N-(4-methoxybutan-2-yl)-3-methylcyclohexane-1-carboxamide
CID 64603719
4-amino-N-(1-hydroxybutan-2-yl)oxolane-3-carboxamide
CID 66240011
2-[(4-aminooxolane-3-carbonyl)amino]-4-methylpentanoic acid
CID 66237264
2-[(4-aminooxolane-3-carbonyl)amino]-3-hydroxybutanoic acid
CID 66237262
4-amino-N-[1-(dimethylamino)-3-methylbutan-2-yl]oxolane-3-carboxamide
CID 66238292
2-[2-(2-methoxyethoxy)ethoxy]ethyl 4-aminooxolane-3-carboxylate
CID 104563231
4-amino-N-[3-(2-methylpropoxy)propyl]oxolane-3-carboxamide
CID 66241397
2-[(4-aminooxolane-3-carbonyl)amino]-4-methylsulfonylbutanoic acid
CID 66235445

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide (CID 66237512) is 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide is COCCC(C)NC(=O)C1COCC1N.
What is the InChIKey of 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide?
The InChIKey is ZJLSWTMXLYWJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7(3-4-14-2)12-10(13)8-5-15-6-9(8)11/h7-9H,3-6,11H2,1-2H3,(H,12,13).
What are the key properties of 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide?
4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-methoxybutan-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66237512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).