3-(2-piperidin-4-ylphenyl)butan-1-amine

C15H24N2 — CID 117336959

IUPAC3-(2-piperidin-4-ylphenyl)butan-1-amine
SMILESCC(CCN)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24N2/c1-12(6-9-16)14-4-2-3-5-15(14)13-7-10-17-11-8-13/h2-5,12-13,17H,6-11,16H2,1H3
InChIKeySVYYVQIPPIKRBW-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.61
Rot. Bonds4

About 3-(2-piperidin-4-ylphenyl)butan-1-amine

3-(2-piperidin-4-ylphenyl)butan-1-amine (PubChem CID 117336959) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-(2-piperidin-4-ylphenyl)butan-1-amine.

Molecular Properties

Compound Name3-(2-piperidin-4-ylphenyl)butan-1-amine
PubChem CID117336959
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name3-(2-piperidin-4-ylphenyl)butan-1-amine
SMILESCC(CCN)c1ccccc1C1CCNCC1
InChIInChI=1S/C15H24N2/c1-12(6-9-16)14-4-2-3-5-15(14)13-7-10-17-11-8-13/h2-5,12-13,17H,6-11,16H2,1H3
InChIKeySVYYVQIPPIKRBW-UHFFFAOYSA-N
XLogP2.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(thietan-3-yl)phenyl]butan-1-amine
CID 117317148
3-[2-(1-methylazepan-4-yl)phenyl]butan-1-amine
CID 117405841
3-(3-piperidin-4-ylphenyl)butan-1-amine
CID 117336960
3-amino-1-(2-cyclopropylphenyl)propan-1-ol
CID 79982961
[1-methyl-5-(2-piperidin-4-ylphenyl)pyrrolidin-3-yl]methanamine
CID 117436780
2-[2-(4-methylcyclohexyl)phenyl]propan-1-ol
CID 117336931
4-(2-fluorophenyl)piperidine;molecular hydrogen
CID 156796206
4-(2-methoxyphenyl)piperidine
CID 544738
4-[2-(piperidin-4-ylmethyl)phenyl]piperidine
CID 117399981
diethyl-(2-piperidin-4-ylphenyl)phosphane
CID 174429999
4-[2-(2-methoxyethoxy)phenyl]piperidine;hydrochloride
CID 163359265
4-(5-chloro-2-propan-2-ylphenyl)piperidine
CID 84700493

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-4-ylphenyl)butan-1-amine?
The IUPAC name of 3-(2-piperidin-4-ylphenyl)butan-1-amine (CID 117336959) is 3-(2-piperidin-4-ylphenyl)butan-1-amine.
What is the SMILES notation for 3-(2-piperidin-4-ylphenyl)butan-1-amine?
The canonical SMILES for 3-(2-piperidin-4-ylphenyl)butan-1-amine is CC(CCN)c1ccccc1C1CCNCC1.
What is the InChIKey of 3-(2-piperidin-4-ylphenyl)butan-1-amine?
The InChIKey is SVYYVQIPPIKRBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12(6-9-16)14-4-2-3-5-15(14)13-7-10-17-11-8-13/h2-5,12-13,17H,6-11,16H2,1H3.
What are the key properties of 3-(2-piperidin-4-ylphenyl)butan-1-amine?
3-(2-piperidin-4-ylphenyl)butan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-4-ylphenyl)butan-1-amine is sourced from PubChem (CID 117336959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).