N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine

C19H25N3 — CID 119126767

IUPACN-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
SMILESCCc1ccc(CNC2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C19H25N3/c1-2-16-6-8-17(9-7-16)15-21-18-10-13-22(14-11-18)19-5-3-4-12-20-19/h3-9,12,18,21H,2,10-11,13-15H2,1H3
InChIKeyBAQQFNHSNLMMFO-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.40
Rot. Bonds5

About N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine

N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine (PubChem CID 119126767) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
PubChem CID119126767
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC NameN-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
SMILESCCc1ccc(CNC2CCN(c3ccccn3)CC2)cc1
InChIInChI=1S/C19H25N3/c1-2-16-6-8-17(9-7-16)15-21-18-10-13-22(14-11-18)19-5-3-4-12-20-19/h3-9,12,18,21H,2,10-11,13-15H2,1H3
InChIKeyBAQQFNHSNLMMFO-UHFFFAOYSA-N
XLogP3.40
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylpyrazol-4-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675359
N-[(3-fluorophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675369
N-[(9-ethylcarbazol-3-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 55767100
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 43675430
N-[(2-aminophenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 66387456
N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
CID 43761755
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 103275609
N-(2-methylsulfanylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 63983974
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 102673300
N-[(6-bromo-2-pyridinyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 115937851
N-(4-ethylcyclohexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675378

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The IUPAC name of N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine (CID 119126767) is N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine is CCc1ccc(CNC2CCN(c3ccccn3)CC2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
The InChIKey is BAQQFNHSNLMMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3/c1-2-16-6-8-17(9-7-16)15-21-18-10-13-22(14-11-18)19-5-3-4-12-20-19/h3-9,12,18,21H,2,10-11,13-15H2,1H3.
What are the key properties of N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine?
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine has a molecular weight of 295.43 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine is sourced from PubChem (CID 119126767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).