N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine

C15H21N — CID 104819458

IUPACN-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine
SMILESCc1ccc(C(CNC2CC2)C2CC2)cc1
InChIInChI=1S/C15H21N/c1-11-2-4-12(5-3-11)15(13-6-7-13)10-16-14-8-9-14/h2-5,13-16H,6-10H2,1H3
InChIKeyJNSDVGBVULWVEG-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.24
Rot. Bonds5

About N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine

N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine (PubChem CID 104819458) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine
PubChem CID104819458
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine
SMILESCc1ccc(C(CNC2CC2)C2CC2)cc1
InChIInChI=1S/C15H21N/c1-11-2-4-12(5-3-11)15(13-6-7-13)10-16-14-8-9-14/h2-5,13-16H,6-10H2,1H3
InChIKeyJNSDVGBVULWVEG-UHFFFAOYSA-N
XLogP3.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]-2-methylpropan-1-amine
CID 104819456
N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]-2-methylpropan-2-amine
CID 104819457
2-cycloheptyl-N-methyl-2-(4-methylphenyl)ethanamine
CID 82933613
N-(2-cycloheptyl-2-pyridin-4-ylethyl)cyclopropanamine
CID 82936425
N-[2-(4-methylphenyl)propyl]cyclopentanamine
CID 115641829
N-[3-methyl-2-(4-methylphenyl)pentyl]cyclopropanamine
CID 79443677
2-cyclobutyl-2-(4-methylphenyl)ethanamine
CID 55269565
N-[2-(4-methylphenyl)-2-(2-methylpropoxy)ethyl]cyclopropanamine
CID 62105975
N-[3-ethoxy-2-(4-methylphenyl)propyl]cyclopropanamine
CID 103984754
(1S)-2-(cycloheptylamino)-1-(4-methylphenyl)ethanol
CID 39350104
N-[2-(cyclopentylmethoxy)-2-(4-methylphenyl)ethyl]cyclopropanamine
CID 66322051
3-cyclopentyl-3-(4-methylphenyl)propan-1-amine
CID 82079151

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine?
The IUPAC name of N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine (CID 104819458) is N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine?
The canonical SMILES for N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine is Cc1ccc(C(CNC2CC2)C2CC2)cc1.
What is the InChIKey of N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine?
The InChIKey is JNSDVGBVULWVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-11-2-4-12(5-3-11)15(13-6-7-13)10-16-14-8-9-14/h2-5,13-16H,6-10H2,1H3.
What are the key properties of N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine?
N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine has a molecular weight of 215.34 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclopropyl-2-(4-methylphenyl)ethyl]cyclopropanamine is sourced from PubChem (CID 104819458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).