N,2-dimethyl-1-phenylpropan-2-amine

C11H17N — CID 3677

IUPACN,2-dimethyl-1-phenylpropan-2-amine
SMILESCNC(C)(C)Cc1ccccc1
InChIInChI=1S/C11H17N/c1-11(2,12-3)9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKeyRXQCGGRTAILOIN-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.23
Rot. Bonds3

About N,2-dimethyl-1-phenylpropan-2-amine

N,2-dimethyl-1-phenylpropan-2-amine (PubChem CID 3677) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is N,2-dimethyl-1-phenylpropan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-phenylpropan-2-amine
PubChem CID3677
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC NameN,2-dimethyl-1-phenylpropan-2-amine
SMILESCNC(C)(C)Cc1ccccc1
InChIInChI=1S/C11H17N/c1-11(2,12-3)9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKeyRXQCGGRTAILOIN-UHFFFAOYSA-N
XLogP2.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-phenylpropan-2-amine?
The IUPAC name of N,2-dimethyl-1-phenylpropan-2-amine (CID 3677) is N,2-dimethyl-1-phenylpropan-2-amine.
What is the SMILES notation for N,2-dimethyl-1-phenylpropan-2-amine?
The canonical SMILES for N,2-dimethyl-1-phenylpropan-2-amine is CNC(C)(C)Cc1ccccc1.
What is the InChIKey of N,2-dimethyl-1-phenylpropan-2-amine?
The InChIKey is RXQCGGRTAILOIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-11(2,12-3)9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3.
What are the key properties of N,2-dimethyl-1-phenylpropan-2-amine?
N,2-dimethyl-1-phenylpropan-2-amine has a molecular weight of 163.26 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-phenylpropan-2-amine is sourced from PubChem (CID 3677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).