N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine

C15H24N2 — CID 105346888

IUPACN-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine
SMILESCCN(Cc1ccc(CCNC)cc1)C1CC1
InChIInChI=1S/C15H24N2/c1-3-17(15-8-9-15)12-14-6-4-13(5-7-14)10-11-16-2/h4-7,15-16H,3,8-12H2,1-2H3
InChIKeyFPAUINYMLMEHSE-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.43
Rot. Bonds7

About N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine

N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine (PubChem CID 105346888) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine
PubChem CID105346888
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine
SMILESCCN(Cc1ccc(CCNC)cc1)C1CC1
InChIInChI=1S/C15H24N2/c1-3-17(15-8-9-15)12-14-6-4-13(5-7-14)10-11-16-2/h4-7,15-16H,3,8-12H2,1-2H3
InChIKeyFPAUINYMLMEHSE-UHFFFAOYSA-N
XLogP2.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine?
The IUPAC name of N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine (CID 105346888) is N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine.
What is the SMILES notation for N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine?
The canonical SMILES for N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine is CCN(Cc1ccc(CCNC)cc1)C1CC1.
What is the InChIKey of N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine?
The InChIKey is FPAUINYMLMEHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-17(15-8-9-15)12-14-6-4-13(5-7-14)10-11-16-2/h4-7,15-16H,3,8-12H2,1-2H3.
What are the key properties of N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine?
N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine has a molecular weight of 232.37 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[4-[2-(methylamino)ethyl]phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 105346888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).