N,N-di(propan-2-yl)oxolane-2-carboxamide

C11H21NO2 — CID 4695421

IUPACN,N-di(propan-2-yl)oxolane-2-carboxamide
SMILESCC(C)N(C(=O)C1CCCO1)C(C)C
InChIInChI=1S/C11H21NO2/c1-8(2)12(9(3)4)11(13)10-6-5-7-14-10/h8-10H,5-7H2,1-4H3
InChIKeyZLXNRWASJGAHFP-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.81
Rot. Bonds3

About N,N-di(propan-2-yl)oxolane-2-carboxamide

N,N-di(propan-2-yl)oxolane-2-carboxamide (PubChem CID 4695421) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N,N-di(propan-2-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)oxolane-2-carboxamide
PubChem CID4695421
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN,N-di(propan-2-yl)oxolane-2-carboxamide
SMILESCC(C)N(C(=O)C1CCCO1)C(C)C
InChIInChI=1S/C11H21NO2/c1-8(2)12(9(3)4)11(13)10-6-5-7-14-10/h8-10H,5-7H2,1-4H3
InChIKeyZLXNRWASJGAHFP-UHFFFAOYSA-N
XLogP1.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-di(propan-2-yl)oxolane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)oxolane-2-carboxamide?
The IUPAC name of N,N-di(propan-2-yl)oxolane-2-carboxamide (CID 4695421) is N,N-di(propan-2-yl)oxolane-2-carboxamide.
What is the SMILES notation for N,N-di(propan-2-yl)oxolane-2-carboxamide?
The canonical SMILES for N,N-di(propan-2-yl)oxolane-2-carboxamide is CC(C)N(C(=O)C1CCCO1)C(C)C.
What is the InChIKey of N,N-di(propan-2-yl)oxolane-2-carboxamide?
The InChIKey is ZLXNRWASJGAHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(2)12(9(3)4)11(13)10-6-5-7-14-10/h8-10H,5-7H2,1-4H3.
What are the key properties of N,N-di(propan-2-yl)oxolane-2-carboxamide?
N,N-di(propan-2-yl)oxolane-2-carboxamide has a molecular weight of 199.29 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)oxolane-2-carboxamide is sourced from PubChem (CID 4695421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).