N-methyl-7-phenylhept-3-en-1-amine

C14H21N — CID 79592715

IUPACN-methyl-7-phenylhept-3-en-1-amine
SMILESCNCCC=CCCCc1ccccc1
InChIInChI=1S/C14H21N/c1-15-13-9-4-2-3-6-10-14-11-7-5-8-12-14/h2,4-5,7-8,11-12,15H,3,6,9-10,13H2,1H3
InChIKeyKEHKMMFFLFJERS-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.17
Rot. Bonds7

About N-methyl-7-phenylhept-3-en-1-amine

N-methyl-7-phenylhept-3-en-1-amine (PubChem CID 79592715) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-methyl-7-phenylhept-3-en-1-amine.

Molecular Properties

Compound NameN-methyl-7-phenylhept-3-en-1-amine
PubChem CID79592715
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-methyl-7-phenylhept-3-en-1-amine
SMILESCNCCC=CCCCc1ccccc1
InChIInChI=1S/C14H21N/c1-15-13-9-4-2-3-6-10-14-11-7-5-8-12-14/h2,4-5,7-8,11-12,15H,3,6,9-10,13H2,1H3
InChIKeyKEHKMMFFLFJERS-UHFFFAOYSA-N
XLogP3.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(E)-5-bromopent-4-enyl]benzene
CID 15076450
N-methyl-9-phenylnonan-1-amine
CID 10609702
dodec-4-enylbenzene
CID 54018856
heptadec-4-enylbenzene
CID 173163087
N-methylmethanamine;N-methyl-2-phenylethanamine
CID 22563284
(E)-6-phenylhex-2-enal
CID 5368478
[(4Z)-8-methylnona-4,8-dienyl]benzene
CID 10775019
[(Z)-heptadec-10-enyl]benzene
CID 175397737
nonadec-10-enylbenzene
CID 54264053
methyl (E)-8-phenyloct-4-enoate
CID 167272629
N-methyl-2-phenylethanamine;ytterbium(3+);trifluoride
CID 175294830
lithium;hydride;N-methyl-2-phenylethanamine
CID 174675590

Frequently Asked Questions

What is the IUPAC name of N-methyl-7-phenylhept-3-en-1-amine?
The IUPAC name of N-methyl-7-phenylhept-3-en-1-amine (CID 79592715) is N-methyl-7-phenylhept-3-en-1-amine.
What is the SMILES notation for N-methyl-7-phenylhept-3-en-1-amine?
The canonical SMILES for N-methyl-7-phenylhept-3-en-1-amine is CNCCC=CCCCc1ccccc1.
What is the InChIKey of N-methyl-7-phenylhept-3-en-1-amine?
The InChIKey is KEHKMMFFLFJERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-15-13-9-4-2-3-6-10-14-11-7-5-8-12-14/h2,4-5,7-8,11-12,15H,3,6,9-10,13H2,1H3.
What are the key properties of N-methyl-7-phenylhept-3-en-1-amine?
N-methyl-7-phenylhept-3-en-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7-phenylhept-3-en-1-amine is sourced from PubChem (CID 79592715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).