3-amino-N-(3-methylbutyl)oxolane-3-carboxamide

C10H20N2O2 — CID 64892075

IUPAC3-amino-N-(3-methylbutyl)oxolane-3-carboxamide
SMILESCC(C)CCNC(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O2/c1-8(2)3-5-12-9(13)10(11)4-6-14-7-10/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyNHNHEEAUINGSHW-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.27
Rot. Bonds4

About 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide

3-amino-N-(3-methylbutyl)oxolane-3-carboxamide (PubChem CID 64892075) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-methylbutyl)oxolane-3-carboxamide
PubChem CID64892075
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-amino-N-(3-methylbutyl)oxolane-3-carboxamide
SMILESCC(C)CCNC(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O2/c1-8(2)3-5-12-9(13)10(11)4-6-14-7-10/h8H,3-7,11H2,1-2H3,(H,12,13)
InChIKeyNHNHEEAUINGSHW-UHFFFAOYSA-N
XLogP0.27
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(3-methylbutyl)cyclopentane-1-carboxamide
CID 60866848
1-amino-N-(3-methylbutyl)cyclobutane-1-carboxamide
CID 81167864
3-amino-N-[3-(methylamino)-3-oxopropyl]oxolane-3-carboxamide
CID 64891010
3-amino-N-(5-amino-5-oxopentyl)oxolane-3-carboxamide
CID 106235837
3-amino-N-(3-methoxy-2-methylpropyl)oxolane-3-carboxamide
CID 64891602
3-amino-N-(2-methyl-3-methylsulfanylpropyl)oxolane-3-carboxamide
CID 64892611
methyl 3-[(3-aminooxolane-3-carbonyl)amino]-2-hydroxypropanoate
CID 107222740
3-[(3-aminooxolane-3-carbonyl)amino]butanoic acid
CID 64894006
3-amino-N-(4,4,4-trifluorobutyl)oxolane-3-carboxamide
CID 115519322
3-amino-N-[2-(4-methylcyclohexyl)ethyl]oxolane-3-carboxamide
CID 64891038
3-amino-N-[2-(azepan-1-yl)ethyl]oxolane-3-carboxamide
CID 64892988
5-[(4-aminooxane-4-carbonyl)amino]-2-methylpentanoic acid
CID 112547775

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide (CID 64892075) is 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide is CC(C)CCNC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide?
The InChIKey is NHNHEEAUINGSHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(2)3-5-12-9(13)10(11)4-6-14-7-10/h8H,3-7,11H2,1-2H3,(H,12,13).
What are the key properties of 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide?
3-amino-N-(3-methylbutyl)oxolane-3-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-methylbutyl)oxolane-3-carboxamide is sourced from PubChem (CID 64892075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).