N-[2-(4-methylphenyl)ethyl]piperidin-4-amine

C14H22N2 — CID 22643507

IUPACN-[2-(4-methylphenyl)ethyl]piperidin-4-amine
SMILESCc1ccc(CCNC2CCNCC2)cc1
InChIInChI=1S/C14H22N2/c1-12-2-4-13(5-3-12)6-11-16-14-7-9-15-10-8-14/h2-5,14-16H,6-11H2,1H3
InChIKeyUOAYALWARYOYQK-UHFFFAOYSA-N
MW218.34 g/mol
LogP1.88
Rot. Bonds4

About N-[2-(4-methylphenyl)ethyl]piperidin-4-amine

N-[2-(4-methylphenyl)ethyl]piperidin-4-amine (PubChem CID 22643507) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-[2-(4-methylphenyl)ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[2-(4-methylphenyl)ethyl]piperidin-4-amine
PubChem CID22643507
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-[2-(4-methylphenyl)ethyl]piperidin-4-amine
SMILESCc1ccc(CCNC2CCNCC2)cc1
InChIInChI=1S/C14H22N2/c1-12-2-4-13(5-3-12)6-11-16-14-7-9-15-10-8-14/h2-5,14-16H,6-11H2,1H3
InChIKeyUOAYALWARYOYQK-UHFFFAOYSA-N
XLogP1.88
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methylphenyl)ethyl]piperidine-4-carboxamide
CID 82130753
N-[2-(4-nitrophenyl)ethyl]azepan-4-amine
CID 103981778
N-[2-(3-bromo-4-methoxyphenyl)ethyl]piperidin-4-amine
CID 115118441
N-[2-(4-ethylphenyl)ethyl]cyclopropanamine
CID 62550255
N-[(3,4-dimethylphenyl)methyl]piperidin-4-amine
CID 83706075
N-(4-phenylbutyl)piperidin-4-amine
CID 44592823
N-[3-(4-methylphenyl)sulfonylpropyl]piperidin-4-amine
CID 118527474
N-[2-(4-butan-2-ylphenyl)ethyl]pyrrolidin-3-amine
CID 115118986
N-[2-(4-fluorophenyl)ethyl]-2,2-dimethylpiperidin-4-amine
CID 115145574
N-[2-(4-methoxy-2,3-dimethylphenyl)ethyl]piperidin-4-amine
CID 115118464
N-[2-(2,5-dimethylphenyl)-2-methylpropyl]piperidin-4-amine
CID 115118553
N-[2-(4-methylphenyl)ethyl]-3-piperidin-4-ylbutanamide
CID 119789313

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylphenyl)ethyl]piperidin-4-amine?
The IUPAC name of N-[2-(4-methylphenyl)ethyl]piperidin-4-amine (CID 22643507) is N-[2-(4-methylphenyl)ethyl]piperidin-4-amine.
What is the SMILES notation for N-[2-(4-methylphenyl)ethyl]piperidin-4-amine?
The canonical SMILES for N-[2-(4-methylphenyl)ethyl]piperidin-4-amine is Cc1ccc(CCNC2CCNCC2)cc1.
What is the InChIKey of N-[2-(4-methylphenyl)ethyl]piperidin-4-amine?
The InChIKey is UOAYALWARYOYQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12-2-4-13(5-3-12)6-11-16-14-7-9-15-10-8-14/h2-5,14-16H,6-11H2,1H3.
What are the key properties of N-[2-(4-methylphenyl)ethyl]piperidin-4-amine?
N-[2-(4-methylphenyl)ethyl]piperidin-4-amine has a molecular weight of 218.34 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenyl)ethyl]piperidin-4-amine is sourced from PubChem (CID 22643507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).