[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine

C13H25NO — CID 103138394

IUPAC[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine
SMILESCC1CCC(CC2(CN)CCCCC2)O1
InChIInChI=1S/C13H25NO/c1-11-5-6-12(15-11)9-13(10-14)7-3-2-4-8-13/h11-12H,2-10,14H2,1H3
InChIKeyPEDLRVHFKYUJLN-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.85
Rot. Bonds3

About [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine

[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine (PubChem CID 103138394) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine
PubChem CID103138394
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine
SMILESCC1CCC(CC2(CN)CCCCC2)O1
InChIInChI=1S/C13H25NO/c1-11-5-6-12(15-11)9-13(10-14)7-3-2-4-8-13/h11-12H,2-10,14H2,1H3
InChIKeyPEDLRVHFKYUJLN-UHFFFAOYSA-N
XLogP2.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(5-methyloxolan-2-yl)methyl]cyclopentyl]methanamine
CID 103138397
1-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-amine
CID 103142102
2-methoxy-N-[[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methyl]ethanamine
CID 103138492
[1-[(5-methyloxolan-2-yl)methoxy]cycloheptyl]methanamine
CID 103132528
[1-(1-oxaspiro[4.4]nonan-2-ylmethyl)cyclooctyl]methanamine
CID 102901881
[1-(1-oxaspiro[4.4]nonan-2-ylmethyl)cyclohexyl]methanamine
CID 102900287
1-[(5-methyloxolan-2-yl)methyl]cyclooctane-1-carbonitrile
CID 103142237
[1-(oxolan-2-ylmethyl)cyclooctyl]methanamine
CID 80603057
[(2R,5R)-5-methyloxolan-2-yl]methanamine
CID 124512926
[3-methyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)cyclohexyl]methanamine
CID 102901857
[1-[[(5-methyloxolan-2-yl)methylamino]methyl]cyclopentyl]methanol
CID 82836590
[4,4-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)cyclohexyl]methanamine
CID 102901865

Frequently Asked Questions

What is the IUPAC name of [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine?
The IUPAC name of [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine (CID 103138394) is [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine.
What is the SMILES notation for [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine?
The canonical SMILES for [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine is CC1CCC(CC2(CN)CCCCC2)O1.
What is the InChIKey of [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine?
The InChIKey is PEDLRVHFKYUJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11-5-6-12(15-11)9-13(10-14)7-3-2-4-8-13/h11-12H,2-10,14H2,1H3.
What are the key properties of [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine?
[1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine has a molecular weight of 211.35 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-methyloxolan-2-yl)methyl]cyclohexyl]methanamine is sourced from PubChem (CID 103138394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).