N-(2-phenylhex-5-enyl)cyclopropanamine

C15H21N — CID 81024536

IUPACN-(2-phenylhex-5-enyl)cyclopropanamine
SMILESC=CCCC(CNC1CC1)c1ccccc1
InChIInChI=1S/C15H21N/c1-2-3-7-14(12-16-15-10-11-15)13-8-5-4-6-9-13/h2,4-6,8-9,14-16H,1,3,7,10-12H2
InChIKeyFSYUQDRHONFUQR-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.49
Rot. Bonds7

About N-(2-phenylhex-5-enyl)cyclopropanamine

N-(2-phenylhex-5-enyl)cyclopropanamine (PubChem CID 81024536) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-(2-phenylhex-5-enyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-phenylhex-5-enyl)cyclopropanamine
PubChem CID81024536
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-(2-phenylhex-5-enyl)cyclopropanamine
SMILESC=CCCC(CNC1CC1)c1ccccc1
InChIInChI=1S/C15H21N/c1-2-3-7-14(12-16-15-10-11-15)13-8-5-4-6-9-13/h2,4-6,8-9,14-16H,1,3,7,10-12H2
InChIKeyFSYUQDRHONFUQR-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
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-phenylhex-5-ynyl)cyclopropanamine
CID 81024680
N-(2-phenylnonyl)cyclopropanamine
CID 65431169
N-(2-phenylbutyl)cyclopentanamine
CID 60664890
N-[3-(2-bicyclo[2.2.1]heptanyl)-2-phenylpropyl]cyclopropanamine
CID 79561966
N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine
CID 65430983
N-(2-methylhex-5-enyl)cyclopropanamine
CID 64663946
N-[4-(5-bromo-2-pyridinyl)-2-phenylbutyl]cyclopropanamine
CID 104813898
N-(2-phenylpropyl)cyclopropanamine;hydrochloride
CID 17158330
N-[2-phenyl-3-(1-propan-2-ylpyrazol-3-yl)propyl]cyclopropanamine
CID 65430604
5-(cyclobutylamino)-4-phenylpentan-2-ol
CID 110021962
1-N-cyclopropyl-2-N-(2-phenylbutyl)propane-1,2-diamine
CID 113407445
N-[4-(1-ethylimidazol-2-yl)-2-phenylbutyl]cyclopropanamine
CID 81027997

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylhex-5-enyl)cyclopropanamine?
The IUPAC name of N-(2-phenylhex-5-enyl)cyclopropanamine (CID 81024536) is N-(2-phenylhex-5-enyl)cyclopropanamine.
What is the SMILES notation for N-(2-phenylhex-5-enyl)cyclopropanamine?
The canonical SMILES for N-(2-phenylhex-5-enyl)cyclopropanamine is C=CCCC(CNC1CC1)c1ccccc1.
What is the InChIKey of N-(2-phenylhex-5-enyl)cyclopropanamine?
The InChIKey is FSYUQDRHONFUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-2-3-7-14(12-16-15-10-11-15)13-8-5-4-6-9-13/h2,4-6,8-9,14-16H,1,3,7,10-12H2.
What are the key properties of N-(2-phenylhex-5-enyl)cyclopropanamine?
N-(2-phenylhex-5-enyl)cyclopropanamine has a molecular weight of 215.34 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylhex-5-enyl)cyclopropanamine is sourced from PubChem (CID 81024536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).