4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine

C15H24N2 — CID 83539442

IUPAC4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine
SMILESCc1ccccc1C1CCN(C(C)C)CC1N
InChIInChI=1S/C15H24N2/c1-11(2)17-9-8-14(15(16)10-17)13-7-5-4-6-12(13)3/h4-7,11,14-15H,8-10,16H2,1-3H3
InChIKeyZGGLACJEECZQHC-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.52
Rot. Bonds2

About 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine

4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine (PubChem CID 83539442) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine.

Molecular Properties

Compound Name4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine
PubChem CID83539442
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine
SMILESCc1ccccc1C1CCN(C(C)C)CC1N
InChIInChI=1S/C15H24N2/c1-11(2)17-9-8-14(15(16)10-17)13-7-5-4-6-12(13)3/h4-7,11,14-15H,8-10,16H2,1-3H3
InChIKeyZGGLACJEECZQHC-UHFFFAOYSA-N
XLogP2.52
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methoxyphenyl)-1-propan-2-ylpiperidin-3-amine
CID 83546673
2-(2-methylphenyl)-4-propan-2-ylcyclohexan-1-amine
CID 81013335
tert-butyl (3S,4S)-3-amino-4-(2-methylphenyl)piperidine-1-carboxylate
CID 39872168
4-(3-methoxyphenyl)-1-propan-2-ylpiperidin-3-amine
CID 83546674
(4aS,10bS)-2-propan-2-yl-1,3,4,4a,6,10b-hexahydroisochromeno[4,3-c]pyridine
CID 22806495
(3R,4R)-3-(2-methylphenyl)-1-(3,4,5-trimethoxyphenyl)piperidin-4-amine
CID 11696837
3-phenyl-1-propan-2-ylpyrrolidine
CID 3447557
(1R)-1-[(1S,2S)-2-(2-methylphenyl)cyclopropyl]ethanamine
CID 28912263
4-methyl-3-(2-methylphenyl)cyclohexan-1-amine
CID 165497411
methyl (3R,4S)-1-methyl-4-(2-methylphenyl)piperidine-3-carboxylate
CID 143099801
3-(2-methylphenyl)-1,1-dioxothian-4-amine
CID 84799838
[(3R,4S)-1-benzyl-4-(2-methylphenyl)piperidin-3-yl]methanol
CID 141122273

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine?
The IUPAC name of 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine (CID 83539442) is 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine.
What is the SMILES notation for 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine?
The canonical SMILES for 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine is Cc1ccccc1C1CCN(C(C)C)CC1N.
What is the InChIKey of 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine?
The InChIKey is ZGGLACJEECZQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11(2)17-9-8-14(15(16)10-17)13-7-5-4-6-12(13)3/h4-7,11,14-15H,8-10,16H2,1-3H3.
What are the key properties of 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine?
4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine has a molecular weight of 232.37 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylphenyl)-1-propan-2-ylpiperidin-3-amine is sourced from PubChem (CID 83539442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).