N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine

C16H26N2 — CID 115118500

IUPACN-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine
SMILESCCc1ccc(CCN(C)C2CCNCC2)cc1
InChIInChI=1S/C16H26N2/c1-3-14-4-6-15(7-5-14)10-13-18(2)16-8-11-17-12-9-16/h4-7,16-17H,3,8-13H2,1-2H3
InChIKeyFWQZRDSRSGSPFP-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.48
Rot. Bonds5

About N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine

N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine (PubChem CID 115118500) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine
PubChem CID115118500
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine
SMILESCCc1ccc(CCN(C)C2CCNCC2)cc1
InChIInChI=1S/C16H26N2/c1-3-14-4-6-15(7-5-14)10-13-18(2)16-8-11-17-12-9-16/h4-7,16-17H,3,8-13H2,1-2H3
InChIKeyFWQZRDSRSGSPFP-UHFFFAOYSA-N
XLogP2.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidin-4-amine;hydrochloride
CID 119913713
N-methyl-N-(2-phenylethyl)azepan-4-amine
CID 65486182
4-[2-(4-ethylphenyl)ethyl-methylamino]cyclohexan-1-one
CID 117039757
N,N'-dimethyl-N,N'-di(piperidin-4-yl)ethane-1,2-diamine;tetrahydrochloride
CID 18770418
N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine
CID 117040771
N-[2-(1,3-benzoxazol-6-yl)ethyl]-N-methylpiperidin-4-amine
CID 115118528
N-[2-(3,4-difluorophenyl)ethyl]-N-methylpyrrolidin-3-amine
CID 115119108
N-[(4-ethylphenyl)methyl]-N-methyl-2-piperidin-4-ylethanamine
CID 115211655
1-(5-amino-1H-1,2,4-triazol-3-yl)-N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine
CID 118165413
N-butyl-N-methylpiperidin-4-amine;dihydrochloride
CID 53410849
4-ethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823008
N,N-bis(2-phenylethyl)piperidin-4-amine
CID 118109179

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine?
The IUPAC name of N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine (CID 115118500) is N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine.
What is the SMILES notation for N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine?
The canonical SMILES for N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine is CCc1ccc(CCN(C)C2CCNCC2)cc1.
What is the InChIKey of N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine?
The InChIKey is FWQZRDSRSGSPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-14-4-6-15(7-5-14)10-13-18(2)16-8-11-17-12-9-16/h4-7,16-17H,3,8-13H2,1-2H3.
What are the key properties of N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine?
N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine has a molecular weight of 246.40 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine is sourced from PubChem (CID 115118500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).