N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine

C15H21N — CID 172569226

IUPACN-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine
SMILESC=C(C)CNC(=C)CCCc1ccccc1
InChIInChI=1S/C15H21N/c1-13(2)12-16-14(3)8-7-11-15-9-5-4-6-10-15/h4-6,9-10,16H,1,3,7-8,11-12H2,2H3
InChIKeyFKLFPJDRLIOLCK-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.69
Rot. Bonds7

About N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine

N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine (PubChem CID 172569226) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine.

Molecular Properties

Compound NameN-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine
PubChem CID172569226
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine
SMILESC=C(C)CNC(=C)CCCc1ccccc1
InChIInChI=1S/C15H21N/c1-13(2)12-16-14(3)8-7-11-15-9-5-4-6-10-15/h4-6,9-10,16H,1,3,7-8,11-12H2,2H3
InChIKeyFKLFPJDRLIOLCK-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methylprop-2-enyl)-3-phenylpropanamide
CID 11469759
5-phenylpentan-2-one
CID 16701
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CID 104983666
ethane;N-methyl-4-phenylbut-1-en-2-amine
CID 143280576
[(4Z)-8-methylnona-4,8-dienyl]benzene
CID 10775019
1-benzyl-1-methyl-3-(2-methylprop-2-enyl)thiourea
CID 4166728
2-[[amino-(2-methylprop-2-enylamino)methylidene]amino]-N-(2-phenylethyl)acetamide
CID 111090997
4-phenylbutylbenzene
CID 141301927
4-phenyl-N-(2-phenylethyl)butanamide;propane
CID 143447835
2-methyl-6-phenylhex-1-en-3-ol
CID 23207508
methyl 2-(7-phenylheptanoylamino)acetate
CID 44563078
2-methyl-N-(4-phenylbut-1-en-2-yl)pentan-1-amine
CID 134189171

Frequently Asked Questions

What is the IUPAC name of N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine?
The IUPAC name of N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine (CID 172569226) is N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine.
What is the SMILES notation for N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine?
The canonical SMILES for N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine is C=C(C)CNC(=C)CCCc1ccccc1.
What is the InChIKey of N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine?
The InChIKey is FKLFPJDRLIOLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-13(2)12-16-14(3)8-7-11-15-9-5-4-6-10-15/h4-6,9-10,16H,1,3,7-8,11-12H2,2H3.
What are the key properties of N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine?
N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine has a molecular weight of 215.34 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylprop-2-enyl)-5-phenylpent-1-en-2-amine is sourced from PubChem (CID 172569226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).