5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine

C13H25NO — CID 103392185

IUPAC5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine
SMILESCOCC(=CC1CCCCC1)CCCN
InChIInChI=1S/C13H25NO/c1-15-11-13(8-5-9-14)10-12-6-3-2-4-7-12/h10,12H,2-9,11,14H2,1H3
InChIKeyUMTMZSIWJAXGLG-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.88
Rot. Bonds6

About 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine

5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine (PubChem CID 103392185) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine.

Molecular Properties

Compound Name5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine
PubChem CID103392185
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine
SMILESCOCC(=CC1CCCCC1)CCCN
InChIInChI=1S/C13H25NO/c1-15-11-13(8-5-9-14)10-12-6-3-2-4-7-12/h10,12H,2-9,11,14H2,1H3
InChIKeyUMTMZSIWJAXGLG-UHFFFAOYSA-N
XLogP2.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(1S)-3-(trifluoromethoxymethyl)cyclohex-3-en-1-yl]methanamine
CID 118640494
5-(3,3-Difluorocyclohexyl)-4-(methoxymethyl)pent-4-en-1-amine
CID 114225487
4-[4-(Methoxymethyl)cyclohex-3-en-1-yl]butan-2-amine
CID 68340930
[(4S)-4-methoxycyclohex-2-en-1-yl]methanamine
CID 89381392
2-[(1S)-4-methoxy-5-methylidenecyclopent-2-en-1-yl]ethanamine
CID 129253890
[(1S,4S)-2-(methoxymethyl)-4-methylcyclohex-2-en-1-yl]methanamine
CID 131971212
2-(6-Methoxy-6-methylcyclohexen-1-yl)ethanamine
CID 163539644
(4-Methoxycyclohex-2-en-1-yl)methanamine
CID 174928028
(E)-2-cyclohexyl-3-(5-methyloxolan-2-yl)prop-2-en-1-amine
CID 82838799
4-(Methoxymethyl)hex-4-en-1-amine
CID 103392067
4-(Methoxymethyl)-6-methylhept-4-en-1-amine
CID 103392068
(Z)-4-(methoxymethyl)dec-4-en-1-amine
CID 103392069

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine?
The IUPAC name of 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine (CID 103392185) is 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine.
What is the SMILES notation for 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine?
The canonical SMILES for 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine is COCC(=CC1CCCCC1)CCCN.
What is the InChIKey of 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine?
The InChIKey is UMTMZSIWJAXGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-15-11-13(8-5-9-14)10-12-6-3-2-4-7-12/h10,12H,2-9,11,14H2,1H3.
What are the key properties of 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine?
5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine has a molecular weight of 211.35 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-4-(methoxymethyl)pent-4-en-1-amine is sourced from PubChem (CID 103392185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).