N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide

C10H20N2O2 — CID 81324675

IUPACN-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide
SMILESCC(CN)CNC(=O)C1CCC(C)O1
InChIInChI=1S/C10H20N2O2/c1-7(5-11)6-12-10(13)9-4-3-8(2)14-9/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyIZKXVSQRTTUOIO-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.26
Rot. Bonds4

About N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide

N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide (PubChem CID 81324675) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide
PubChem CID81324675
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide
SMILESCC(CN)CNC(=O)C1CCC(C)O1
InChIInChI=1S/C10H20N2O2/c1-7(5-11)6-12-10(13)9-4-3-8(2)14-9/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyIZKXVSQRTTUOIO-UHFFFAOYSA-N
XLogP0.26
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 ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide (CID 81324675) is N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide is CC(CN)CNC(=O)C1CCC(C)O1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide?
The InChIKey is IZKXVSQRTTUOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(5-11)6-12-10(13)9-4-3-8(2)14-9/h7-9H,3-6,11H2,1-2H3,(H,12,13).
What are the key properties of N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide?
N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 81324675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).