6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

C19H27NO — CID 114619764

IUPAC6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1CCCc2cc(OC3C=CCCC3)ccc21
InChIInChI=1S/C19H27NO/c1-2-13-20-19-10-6-7-15-14-17(11-12-18(15)19)21-16-8-4-3-5-9-16/h4,8,11-12,14,16,19-20H,2-3,5-7,9-10,13H2,1H3
InChIKeyZGHRQFSWXVLLAO-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.55
Rot. Bonds5

About 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine

6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 114619764) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID114619764
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC Name6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCNC1CCCc2cc(OC3C=CCCC3)ccc21
InChIInChI=1S/C19H27NO/c1-2-13-20-19-10-6-7-15-14-17(11-12-18(15)19)21-16-8-4-3-5-9-16/h4,8,11-12,14,16,19-20H,2-3,5-7,9-10,13H2,1H3
InChIKeyZGHRQFSWXVLLAO-UHFFFAOYSA-N
XLogP4.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.55
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

4-cyclohex-2-en-1-yloxy-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 114619832
6-(4-methoxybutoxy)-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 104647002
2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
CID 3016750
3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 43206577
5-pentan-3-yloxy-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 107683877
5-butan-2-yloxy-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 107683888
3-[[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propanenitrile
CID 28728583
5-[2-(dimethylamino)ethoxy]-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 107684000
3-[[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl]pentan-3-ol
CID 65105549
6-methoxy-N-(5-methylhexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115324453
1-cyclohex-2-en-1-yloxy-3-methylbenzene
CID 91516514
N-[(3-cyclohex-2-en-1-yloxyphenyl)methyl]cyclopropanamine
CID 114619665

Frequently Asked Questions

What is the IUPAC name of 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 114619764) is 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCCNC1CCCc2cc(OC3C=CCCC3)ccc21.
What is the InChIKey of 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is ZGHRQFSWXVLLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-2-13-20-19-10-6-7-15-14-17(11-12-18(15)19)21-16-8-4-3-5-9-16/h4,8,11-12,14,16,19-20H,2-3,5-7,9-10,13H2,1H3.
What are the key properties of 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine?
6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 285.43 g/mol, XLogP of 4.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohex-2-en-1-yloxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 114619764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).