3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine

C11H21NO — CID 104995296

IUPAC3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine
SMILESCC1CC(C(N)CCC2CC2)CO1
InChIInChI=1S/C11H21NO/c1-8-6-10(7-13-8)11(12)5-4-9-2-3-9/h8-11H,2-7,12H2,1H3
InChIKeyBSMDFXAWRDGYDE-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.93
Rot. Bonds4

About 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine

3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine (PubChem CID 104995296) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine
PubChem CID104995296
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine
SMILESCC1CC(C(N)CCC2CC2)CO1
InChIInChI=1S/C11H21NO/c1-8-6-10(7-13-8)11(12)5-4-9-2-3-9/h8-11H,2-7,12H2,1H3
InChIKeyBSMDFXAWRDGYDE-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 105055175
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1-cyclooctyl-3-cyclopropylpropan-1-amine
CID 80603761
3-cyclohexyl-1-cyclopropylpropan-1-amine
CID 63355132
2-amino-2-(5-methyloxolan-3-yl)acetic acid
CID 170558301
2-(2,6-difluorophenyl)-1-(5-methyloxolan-3-yl)ethanamine
CID 114825914
1-(2-methyloxan-4-yl)propan-1-amine
CID 79308467
(2R)-4-cyclopropylbutan-2-amine
CID 95367313
2-(3,4-dichlorophenyl)-1-(5-methyloxolan-3-yl)ethanamine
CID 114825906
1-(5-methyloxolan-3-yl)propan-1-ol
CID 115787725
1-(5-methyloxolan-3-yl)pentylhydrazine
CID 105293859
2-(2-bromo-3-fluorophenyl)-1-(5-methyloxolan-3-yl)ethanamine
CID 105020731

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine?
The IUPAC name of 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine (CID 104995296) is 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine.
What is the SMILES notation for 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine?
The canonical SMILES for 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine is CC1CC(C(N)CCC2CC2)CO1.
What is the InChIKey of 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine?
The InChIKey is BSMDFXAWRDGYDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8-6-10(7-13-8)11(12)5-4-9-2-3-9/h8-11H,2-7,12H2,1H3.
What are the key properties of 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine?
3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine has a molecular weight of 183.29 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(5-methyloxolan-3-yl)propan-1-amine is sourced from PubChem (CID 104995296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).