3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine

C15H27NO2 — CID 104705790

IUPAC3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine
SMILESCOC1(CNC2CCCC(C3CC3)C2)CCOC1
InChIInChI=1S/C15H27NO2/c1-17-15(7-8-18-11-15)10-16-14-4-2-3-13(9-14)12-5-6-12/h12-14,16H,2-11H2,1H3
InChIKeySXRZDORSPQLZRG-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.35
Rot. Bonds5

About 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine

3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine (PubChem CID 104705790) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine
PubChem CID104705790
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine
SMILESCOC1(CNC2CCCC(C3CC3)C2)CCOC1
InChIInChI=1S/C15H27NO2/c1-17-15(7-8-18-11-15)10-16-14-4-2-3-13(9-14)12-5-6-12/h12-14,16H,2-11H2,1H3
InChIKeySXRZDORSPQLZRG-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methoxyoxolan-3-yl)methyl]-3-methylsulfonylcyclohexan-1-amine
CID 104760803
N-[(3-methoxyoxolan-3-yl)methyl]piperidin-3-amine
CID 104759714
4-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexane-1,4-diamine
CID 104759812
N-[(3-methoxyoxolan-3-yl)methyl]spiro[3.5]nonan-3-amine
CID 102952349
3-(4-bromophenyl)-N-[(3-methoxyoxolan-3-yl)methyl]cyclobutan-1-amine
CID 104759771
3-cyclopropyl-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]cyclohexan-1-amine
CID 103903916
N-[(3-methoxyoxolan-3-yl)methyl]-2-phenylcyclohexan-1-amine
CID 104705865
3-cyclopropyl-N-[(1-propylcyclopropyl)methyl]cyclohexan-1-amine
CID 114099645
N-[(3-methoxyoxolan-3-yl)methyl]-3-(3-methoxyphenyl)cyclobutan-1-amine
CID 104759729
1-benzyl-N-[(3-methoxyoxolan-3-yl)methyl]pyrrolidin-3-amine
CID 104705115
N-[(3-methoxyoxolan-3-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 104759668
N-[(3-methoxyoxolan-3-yl)methyl]-1-(oxan-4-yl)methanamine
CID 104704975

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine (CID 104705790) is 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine is COC1(CNC2CCCC(C3CC3)C2)CCOC1.
What is the InChIKey of 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine?
The InChIKey is SXRZDORSPQLZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-17-15(7-8-18-11-15)10-16-14-4-2-3-13(9-14)12-5-6-12/h12-14,16H,2-11H2,1H3.
What are the key properties of 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine?
3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine has a molecular weight of 253.39 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(3-methoxyoxolan-3-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 104705790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).