1-[1-(4-methylphenyl)propyl]piperidin-3-amine

C15H24N2 — CID 61297923

IUPAC1-[1-(4-methylphenyl)propyl]piperidin-3-amine
SMILESCCC(c1ccc(C)cc1)N1CCCC(N)C1
InChIInChI=1S/C15H24N2/c1-3-15(13-8-6-12(2)7-9-13)17-10-4-5-14(16)11-17/h6-9,14-15H,3-5,10-11,16H2,1-2H3
InChIKeySKNIKQHGNHVYDF-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.87
Rot. Bonds3

About 1-[1-(4-methylphenyl)propyl]piperidin-3-amine

1-[1-(4-methylphenyl)propyl]piperidin-3-amine (PubChem CID 61297923) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[1-(4-methylphenyl)propyl]piperidin-3-amine.

Molecular Properties

Compound Name1-[1-(4-methylphenyl)propyl]piperidin-3-amine
PubChem CID61297923
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[1-(4-methylphenyl)propyl]piperidin-3-amine
SMILESCCC(c1ccc(C)cc1)N1CCCC(N)C1
InChIInChI=1S/C15H24N2/c1-3-15(13-8-6-12(2)7-9-13)17-10-4-5-14(16)11-17/h6-9,14-15H,3-5,10-11,16H2,1-2H3
InChIKeySKNIKQHGNHVYDF-UHFFFAOYSA-N
XLogP2.87
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 ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methylphenyl)propyl]piperidin-3-amine?
The IUPAC name of 1-[1-(4-methylphenyl)propyl]piperidin-3-amine (CID 61297923) is 1-[1-(4-methylphenyl)propyl]piperidin-3-amine.
What is the SMILES notation for 1-[1-(4-methylphenyl)propyl]piperidin-3-amine?
The canonical SMILES for 1-[1-(4-methylphenyl)propyl]piperidin-3-amine is CCC(c1ccc(C)cc1)N1CCCC(N)C1.
What is the InChIKey of 1-[1-(4-methylphenyl)propyl]piperidin-3-amine?
The InChIKey is SKNIKQHGNHVYDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-15(13-8-6-12(2)7-9-13)17-10-4-5-14(16)11-17/h6-9,14-15H,3-5,10-11,16H2,1-2H3.
What are the key properties of 1-[1-(4-methylphenyl)propyl]piperidin-3-amine?
1-[1-(4-methylphenyl)propyl]piperidin-3-amine has a molecular weight of 232.37 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methylphenyl)propyl]piperidin-3-amine is sourced from PubChem (CID 61297923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).