2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine

C15H24N2 — CID 79686677

IUPAC2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine
SMILESCC1CCCN1c1ccc(C(C)(C)CN)cc1
InChIInChI=1S/C15H24N2/c1-12-5-4-10-17(12)14-8-6-13(7-9-14)15(2,3)11-16/h6-9,12H,4-5,10-11,16H2,1-3H3
InChIKeyQZDJOAMVDPRBHF-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.91
Rot. Bonds3

About 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine

2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine (PubChem CID 79686677) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine
PubChem CID79686677
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine
SMILESCC1CCCN1c1ccc(C(C)(C)CN)cc1
InChIInChI=1S/C15H24N2/c1-12-5-4-10-17(12)14-8-6-13(7-9-14)15(2,3)11-16/h6-9,12H,4-5,10-11,16H2,1-3H3
InChIKeyQZDJOAMVDPRBHF-UHFFFAOYSA-N
XLogP2.91
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine?
The IUPAC name of 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine (CID 79686677) is 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine.
What is the SMILES notation for 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine?
The canonical SMILES for 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine is CC1CCCN1c1ccc(C(C)(C)CN)cc1.
What is the InChIKey of 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine?
The InChIKey is QZDJOAMVDPRBHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-5-4-10-17(12)14-8-6-13(7-9-14)15(2,3)11-16/h6-9,12H,4-5,10-11,16H2,1-3H3.
What are the key properties of 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine?
2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[4-(2-methylpyrrolidin-1-yl)phenyl]propan-1-amine is sourced from PubChem (CID 79686677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).