3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine

C15H24N2 — CID 82082601

IUPAC3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine
SMILESCc1ccccc1C(CCN)N1CCCCC1
InChIInChI=1S/C15H24N2/c1-13-7-3-4-8-14(13)15(9-10-16)17-11-5-2-6-12-17/h3-4,7-8,15H,2,5-6,9-12,16H2,1H3
InChIKeyNNCFYWNZODBXOE-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.87
Rot. Bonds4

About 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine

3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine (PubChem CID 82082601) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine
PubChem CID82082601
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine
SMILESCc1ccccc1C(CCN)N1CCCCC1
InChIInChI=1S/C15H24N2/c1-13-7-3-4-8-14(13)15(9-10-16)17-11-5-2-6-12-17/h3-4,7-8,15H,2,5-6,9-12,16H2,1H3
InChIKeyNNCFYWNZODBXOE-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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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Related Compounds

3-(2-methyl-4-phenylmethoxyphenyl)-3-pyrrolidin-1-ylpropan-1-amine
CID 83937117
3-(4-methylphenyl)-3-piperidin-1-ylpropan-1-amine
CID 82023207
2-(4-methylazepan-1-yl)-2-(2-methylphenyl)ethanamine
CID 63622557
2-(4,4-dimethylpiperidin-1-yl)-2-(2-methylphenyl)ethanamine
CID 62935471
3-[2-methyl-4-(2-methylpropoxy)phenyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 83936988
(2S)-2-(2-methylphenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 51656542
2-(3,4-dimethylpyrrolidin-1-yl)-2-(2-methylphenyl)ethanamine
CID 79182595
2-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(2-methylphenyl)ethanamine
CID 43581361
3-(2-ethoxy-3,5-dimethylphenyl)-3-pyrrolidin-1-ylpropan-1-amine
CID 83942051
2-(azepan-1-yl)-2-(2-ethylphenyl)ethanamine
CID 62392801
3-pyrrolidin-1-yl-3-(2,3,4-trimethoxyphenyl)propan-1-amine
CID 83934065
3-(3-ethoxyphenyl)-3-piperidin-1-ylpropan-1-amine
CID 112509278

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine?
The IUPAC name of 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine (CID 82082601) is 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine.
What is the SMILES notation for 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine?
The canonical SMILES for 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine is Cc1ccccc1C(CCN)N1CCCCC1.
What is the InChIKey of 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine?
The InChIKey is NNCFYWNZODBXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-7-3-4-8-14(13)15(9-10-16)17-11-5-2-6-12-17/h3-4,7-8,15H,2,5-6,9-12,16H2,1H3.
What are the key properties of 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine?
3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylphenyl)-3-piperidin-1-ylpropan-1-amine is sourced from PubChem (CID 82082601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).