N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine

C20H25N — CID 65430983

IUPACN-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine
SMILESCCc1ccc(CC(CNC2CC2)c2ccccc2)cc1
InChIInChI=1S/C20H25N/c1-2-16-8-10-17(11-9-16)14-19(15-21-20-12-13-20)18-6-4-3-5-7-18/h3-11,19-21H,2,12-15H2,1H3
InChIKeyLEMVLHCHMXQLPD-UHFFFAOYSA-N
MW279.43 g/mol
LogP4.33
Rot. Bonds7

About N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine

N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine (PubChem CID 65430983) has the molecular formula C20H25N and a molecular weight of 279.43 g/mol. Its IUPAC name is N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine
PubChem CID65430983
Molecular FormulaC20H25N
Molecular Weight279.43 g/mol
Exact Mass279.20
IUPAC NameN-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine
SMILESCCc1ccc(CC(CNC2CC2)c2ccccc2)cc1
InChIInChI=1S/C20H25N/c1-2-16-8-10-17(11-9-16)14-19(15-21-20-12-13-20)18-6-4-3-5-7-18/h3-11,19-21H,2,12-15H2,1H3
InChIKeyLEMVLHCHMXQLPD-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-phenylbutyl)cyclopentanamine
CID 60664890
N-(2-phenylnonyl)cyclopropanamine
CID 65431169
N-[3-(5-fluoro-2-methylphenyl)-2-phenylpropyl]cyclopropanamine
CID 81027097
1-cyclopropyl-3-(2,3-diphenylpropyl)urea
CID 110307425
N-[3-(4-ethylphenyl)-2-methylbutyl]cyclopropanamine
CID 81015305
1-N-cyclopropyl-2-N-(2-phenylbutyl)propane-1,2-diamine
CID 113407445
N-[3-(2-methyl-1,3-thiazol-5-yl)-2-phenylpropyl]cyclopropanamine
CID 65431171
N-[2-phenyl-3-(1-propan-2-ylpyrazol-3-yl)propyl]cyclopropanamine
CID 65430604
N-(2-phenylpropyl)cyclopropanamine;hydrochloride
CID 17158330
N-(2-phenylhex-5-ynyl)cyclopropanamine
CID 81024680
N-(2-phenylhex-5-enyl)cyclopropanamine
CID 81024536
N-[2,3-bis(3-chlorophenyl)propyl]cyclopropanamine
CID 79433698

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine?
The IUPAC name of N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine (CID 65430983) is N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine.
What is the SMILES notation for N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine?
The canonical SMILES for N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine is CCc1ccc(CC(CNC2CC2)c2ccccc2)cc1.
What is the InChIKey of N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine?
The InChIKey is LEMVLHCHMXQLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N/c1-2-16-8-10-17(11-9-16)14-19(15-21-20-12-13-20)18-6-4-3-5-7-18/h3-11,19-21H,2,12-15H2,1H3.
What are the key properties of N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine?
N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine has a molecular weight of 279.43 g/mol, XLogP of 4.33, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-ethylphenyl)-2-phenylpropyl]cyclopropanamine is sourced from PubChem (CID 65430983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).