N,N-dimethyl-2-phenylethanamine;hydrochloride

C10H16ClN — CID 25124

IUPACN,N-dimethyl-2-phenylethanamine;hydrochloride
SMILESCN(C)CCc1ccccc1.Cl
InChIInChI=1S/C10H15N.ClH/c1-11(2)9-8-10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H
InChIKeyOVBRYLBVLSAOAS-UHFFFAOYSA-N
MW185.70 g/mol
LogP2.21
Rot. Bonds3

About N,N-dimethyl-2-phenylethanamine;hydrochloride

N,N-dimethyl-2-phenylethanamine;hydrochloride (PubChem CID 25124) has the molecular formula C10H16ClN and a molecular weight of 185.70 g/mol. Its IUPAC name is N,N-dimethyl-2-phenylethanamine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-2-phenylethanamine;hydrochloride
PubChem CID25124
Molecular FormulaC10H16ClN
Molecular Weight185.70 g/mol
Exact Mass185.10
IUPAC NameN,N-dimethyl-2-phenylethanamine;hydrochloride
SMILESCN(C)CCc1ccccc1.Cl
InChIInChI=1S/C10H15N.ClH/c1-11(2)9-8-10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H
InChIKeyOVBRYLBVLSAOAS-UHFFFAOYSA-N
XLogP2.21
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.70
LogP ≤ 52.21
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;hydrochloride?
The IUPAC name of N,N-dimethyl-2-phenylethanamine;hydrochloride (CID 25124) is N,N-dimethyl-2-phenylethanamine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-2-phenylethanamine;hydrochloride?
The canonical SMILES for N,N-dimethyl-2-phenylethanamine;hydrochloride is CN(C)CCc1ccccc1.Cl.
What is the InChIKey of N,N-dimethyl-2-phenylethanamine;hydrochloride?
The InChIKey is OVBRYLBVLSAOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N.ClH/c1-11(2)9-8-10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H.
What are the key properties of N,N-dimethyl-2-phenylethanamine;hydrochloride?
N,N-dimethyl-2-phenylethanamine;hydrochloride has a molecular weight of 185.70 g/mol, XLogP of 2.21, 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;hydrochloride is sourced from PubChem (CID 25124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).