2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine

C12H23NO2 — CID 103580702

IUPAC2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine
SMILESCC(C)OCCNC1CCOC1C1CC1
InChIInChI=1S/C12H23NO2/c1-9(2)14-8-6-13-11-5-7-15-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3
InChIKeyBURDSMMYINBIMS-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.57
Rot. Bonds6

About 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine

2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine (PubChem CID 103580702) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine
PubChem CID103580702
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine
SMILESCC(C)OCCNC1CCOC1C1CC1
InChIInChI=1S/C12H23NO2/c1-9(2)14-8-6-13-11-5-7-15-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3
InChIKeyBURDSMMYINBIMS-UHFFFAOYSA-N
XLogP1.57
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.57
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 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine (CID 103580702) is 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine is CC(C)OCCNC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine?
The InChIKey is BURDSMMYINBIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-9(2)14-8-6-13-11-5-7-15-12(11)10-3-4-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine?
2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine has a molecular weight of 213.32 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2-propan-2-yloxyethyl)oxolan-3-amine is sourced from PubChem (CID 103580702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).