N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine

C11H21NO — CID 103581449

IUPACN-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine
SMILESCC1OCCC1(C)NCC1CCC1
InChIInChI=1S/C11H21NO/c1-9-11(2,6-7-13-9)12-8-10-4-3-5-10/h9-10,12H,3-8H2,1-2H3
InChIKeyBMPOSEUVUPYVAI-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.94
Rot. Bonds3

About N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine

N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine (PubChem CID 103581449) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine
PubChem CID103581449
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine
SMILESCC1OCCC1(C)NCC1CCC1
InChIInChI=1S/C11H21NO/c1-9-11(2,6-7-13-9)12-8-10-4-3-5-10/h9-10,12H,3-8H2,1-2H3
InChIKeyBMPOSEUVUPYVAI-UHFFFAOYSA-N
XLogP1.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine?
The IUPAC name of N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine (CID 103581449) is N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine?
The canonical SMILES for N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine is CC1OCCC1(C)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine?
The InChIKey is BMPOSEUVUPYVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9-11(2,6-7-13-9)12-8-10-4-3-5-10/h9-10,12H,3-8H2,1-2H3.
What are the key properties of N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine?
N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine has a molecular weight of 183.29 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2,3-dimethyloxolan-3-amine is sourced from PubChem (CID 103581449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).