N-methyl-2-phenylpropan-1-amine;hydrochloride

C10H16ClN — CID 22275

IUPACN-methyl-2-phenylpropan-1-amine;hydrochloride
SMILESCNCC(C)c1ccccc1.Cl
InChIInChI=1S/C10H15N.ClH/c1-9(8-11-2)10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H
InChIKeyOQHDRLTXPGYYJN-UHFFFAOYSA-N
MW185.70 g/mol
LogP2.43
Rot. Bonds3

About N-methyl-2-phenylpropan-1-amine;hydrochloride

N-methyl-2-phenylpropan-1-amine;hydrochloride (PubChem CID 22275) has the molecular formula C10H16ClN and a molecular weight of 185.70 g/mol. Its IUPAC name is N-methyl-2-phenylpropan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-phenylpropan-1-amine;hydrochloride
PubChem CID22275
Molecular FormulaC10H16ClN
Molecular Weight185.70 g/mol
Exact Mass185.10
IUPAC NameN-methyl-2-phenylpropan-1-amine;hydrochloride
SMILESCNCC(C)c1ccccc1.Cl
InChIInChI=1S/C10H15N.ClH/c1-9(8-11-2)10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H
InChIKeyOQHDRLTXPGYYJN-UHFFFAOYSA-N
XLogP2.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.70
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenylpropan-1-amine;hydrochloride?
The IUPAC name of N-methyl-2-phenylpropan-1-amine;hydrochloride (CID 22275) is N-methyl-2-phenylpropan-1-amine;hydrochloride.
What is the SMILES notation for N-methyl-2-phenylpropan-1-amine;hydrochloride?
The canonical SMILES for N-methyl-2-phenylpropan-1-amine;hydrochloride is CNCC(C)c1ccccc1.Cl.
What is the InChIKey of N-methyl-2-phenylpropan-1-amine;hydrochloride?
The InChIKey is OQHDRLTXPGYYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N.ClH/c1-9(8-11-2)10-6-4-3-5-7-10;/h3-7,9,11H,8H2,1-2H3;1H.
What are the key properties of N-methyl-2-phenylpropan-1-amine;hydrochloride?
N-methyl-2-phenylpropan-1-amine;hydrochloride has a molecular weight of 185.70 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenylpropan-1-amine;hydrochloride is sourced from PubChem (CID 22275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).