1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine

C17H22N4 — CID 43343781

IUPAC1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(c2ccncc2)CC1)c1ccccn1
InChIInChI=1S/C17H22N4/c1-14(17-4-2-3-9-19-17)20-15-7-12-21(13-8-15)16-5-10-18-11-6-16/h2-6,9-11,14-15,20H,7-8,12-13H2,1H3
InChIKeyYEYLFJYCMZDDIM-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.80
Rot. Bonds4

About 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine

1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine (PubChem CID 43343781) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine
PubChem CID43343781
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(c2ccncc2)CC1)c1ccccn1
InChIInChI=1S/C17H22N4/c1-14(17-4-2-3-9-19-17)20-15-7-12-21(13-8-15)16-5-10-18-11-6-16/h2-6,9-11,14-15,20H,7-8,12-13H2,1H3
InChIKeyYEYLFJYCMZDDIM-UHFFFAOYSA-N
XLogP2.80
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-N-[(1R)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 106820380
1-[4-(1-pyridin-2-ylethylamino)piperidin-1-yl]ethanone
CID 43223671
N-[(1S)-1-pyridin-2-ylethyl]cycloheptanamine
CID 28647798
N-[(1S)-1-pyridin-2-ylethyl]cyclododecanamine
CID 29052683
N-(1-pyridin-2-ylethyl)cyclooctanamine
CID 43178142
1-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 61461637
1-pyridin-4-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43343794
N,N-dimethyl-4-[[(1S)-1-pyridin-2-ylethyl]amino]piperidine-1-carboxamide
CID 83262155
1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine
CID 43343785
N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 81401330
1,1-dioxo-N-(1-pyridin-2-ylethyl)thian-4-amine
CID 43511597
(3S)-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 71637667

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine?
The IUPAC name of 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine (CID 43343781) is 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine is CC(NC1CCN(c2ccncc2)CC1)c1ccccn1.
What is the InChIKey of 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine?
The InChIKey is YEYLFJYCMZDDIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-14(17-4-2-3-9-19-17)20-15-7-12-21(13-8-15)16-5-10-18-11-6-16/h2-6,9-11,14-15,20H,7-8,12-13H2,1H3.
What are the key properties of 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine?
1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine is sourced from PubChem (CID 43343781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).