3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide

C10H20N2O3 — CID 64891602

IUPAC3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide
SMILESCOCC(C)CNC(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O3/c1-8(6-14-2)5-12-9(13)10(11)3-4-15-7-10/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyNVJLHPBXPOHGSB-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.50
Rot. Bonds5

About 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide

3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide (PubChem CID 64891602) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide
PubChem CID64891602
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide
SMILESCOCC(C)CNC(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O3/c1-8(6-14-2)5-12-9(13)10(11)3-4-15-7-10/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyNVJLHPBXPOHGSB-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

3-amino-N-(2-methyl-3-methylsulfanylpropyl)oxolane-3-carboxamide
CID 64892611
methyl 3-[(3-aminooxolane-3-carbonyl)amino]-2-hydroxypropanoate
CID 107222740
3-amino-N-(3-methylbutyl)oxolane-3-carboxamide
CID 64892075
1-(N'-hydroxycarbamimidoyl)-N-(3-methoxy-2-methylpropyl)cyclohexane-1-carboxamide
CID 76930746
4-amino-N-(3-methyl-2-propan-2-ylbutyl)oxane-4-carboxamide
CID 102905819
3-[(3-aminooxolane-3-carbonyl)amino]butanoic acid
CID 64894006
1-(3-aminooxolan-3-yl)-4-methoxy-2-methylbutan-1-one
CID 116579573
4-amino-N-(2-methyl-3-pyrrolidin-1-ylpropyl)oxane-4-carboxamide
CID 115294865
1-(3-aminooxolan-3-yl)-3-methoxypropan-2-one
CID 152923029
methyl 4-[(1S)-1-[(3-aminooxolane-3-carbonyl)amino]ethyl]benzoate;hydrochloride
CID 163364958
3-amino-N-but-3-yn-2-yloxolane-3-carboxamide
CID 114417231
3-amino-N-[3-(methylamino)-3-oxopropyl]oxolane-3-carboxamide
CID 64891010

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide (CID 64891602) is 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide is COCC(C)CNC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide?
The InChIKey is NVJLHPBXPOHGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-8(6-14-2)5-12-9(13)10(11)3-4-15-7-10/h8H,3-7,11H2,1-2H3,(H,12,13).
What are the key properties of 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide?
3-amino-N-(3-methoxy-2-methylpropyl)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 3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide is sourced from PubChem (CID 64891602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).