N,N-dimethyl-2-phenylethanamine

C10H15N — CID 25125

IUPACN,N-dimethyl-2-phenylethanamine
SMILESCN(C)CCc1ccccc1
InChIInChI=1S/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKeyTXOFSCODFRHERQ-UHFFFAOYSA-N
MW149.24 g/mol
LogP1.79
Rot. Bonds3

About N,N-dimethyl-2-phenylethanamine

N,N-dimethyl-2-phenylethanamine (PubChem CID 25125) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is N,N-dimethyl-2-phenylethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-phenylethanamine
PubChem CID25125
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC NameN,N-dimethyl-2-phenylethanamine
SMILESCN(C)CCc1ccccc1
InChIInChI=1S/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKeyTXOFSCODFRHERQ-UHFFFAOYSA-N
XLogP1.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-phenylethanamine?
The IUPAC name of N,N-dimethyl-2-phenylethanamine (CID 25125) is N,N-dimethyl-2-phenylethanamine.
What is the SMILES notation for N,N-dimethyl-2-phenylethanamine?
The canonical SMILES for N,N-dimethyl-2-phenylethanamine is CN(C)CCc1ccccc1.
What is the InChIKey of N,N-dimethyl-2-phenylethanamine?
The InChIKey is TXOFSCODFRHERQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3.
What are the key properties of N,N-dimethyl-2-phenylethanamine?
N,N-dimethyl-2-phenylethanamine has a molecular weight of 149.24 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-phenylethanamine is sourced from PubChem (CID 25125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).