N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide

C11H21NO3 — CID 2970931

IUPACN-(3-propan-2-yloxypropyl)oxolane-2-carboxamide
SMILESCC(C)OCCCNC(=O)C1CCCO1
InChIInChI=1S/C11H21NO3/c1-9(2)14-8-4-6-12-11(13)10-5-3-7-15-10/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeySXNICAAUSYZFDA-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.10
Rot. Bonds6

About N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide

N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide (PubChem CID 2970931) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(3-propan-2-yloxypropyl)oxolane-2-carboxamide
PubChem CID2970931
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-(3-propan-2-yloxypropyl)oxolane-2-carboxamide
SMILESCC(C)OCCCNC(=O)C1CCCO1
InChIInChI=1S/C11H21NO3/c1-9(2)14-8-4-6-12-11(13)10-5-3-7-15-10/h9-10H,3-8H2,1-2H3,(H,12,13)
InChIKeySXNICAAUSYZFDA-UHFFFAOYSA-N
XLogP1.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide?
The IUPAC name of N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide (CID 2970931) is N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide?
The canonical SMILES for N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide is CC(C)OCCCNC(=O)C1CCCO1.
What is the InChIKey of N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide?
The InChIKey is SXNICAAUSYZFDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(2)14-8-4-6-12-11(13)10-5-3-7-15-10/h9-10H,3-8H2,1-2H3,(H,12,13).
What are the key properties of N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide?
N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide has a molecular weight of 215.29 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-yloxypropyl)oxolane-2-carboxamide is sourced from PubChem (CID 2970931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).