1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine

C17H22N4 — CID 43343785

IUPAC1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(c2ccncc2)CC1)c1cccnc1
InChIInChI=1S/C17H22N4/c1-14(15-3-2-8-19-13-15)20-16-6-11-21(12-7-16)17-4-9-18-10-5-17/h2-5,8-10,13-14,16,20H,6-7,11-12H2,1H3
InChIKeyUIZCOXSEVGIBON-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.80
Rot. Bonds4

About 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine

1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine (PubChem CID 43343785) 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-3-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine
PubChem CID43343785
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(c2ccncc2)CC1)c1cccnc1
InChIInChI=1S/C17H22N4/c1-14(15-3-2-8-19-13-15)20-16-6-11-21(12-7-16)17-4-9-18-10-5-17/h2-5,8-10,13-14,16,20H,6-7,11-12H2,1H3
InChIKeyUIZCOXSEVGIBON-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

N-(1-pyridin-3-ylethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 43675618
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
1-propan-2-yl-N-[(1S)-1-pyridin-3-ylethyl]piperidin-4-amine
CID 28716728
1-[4-[[(1S)-1-pyridin-3-ylethyl]amino]piperidin-1-yl]ethanone
CID 78950814
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
1-pyridin-4-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43343794
1-pyridin-4-yl-N-(1-thiophen-3-ylethyl)piperidin-4-amine
CID 62841839
4-[[(1S)-1-pyridin-3-ylethyl]amino]piperidine-1-carboxamide
CID 81344365
N-[(1S)-1-pyridin-3-ylethyl]azetidin-3-amine
CID 81406806
1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)piperidin-4-amine
CID 43343781
N-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 79724749

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine?
The IUPAC name of 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine (CID 43343785) is 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine is CC(NC1CCN(c2ccncc2)CC1)c1cccnc1.
What is the InChIKey of 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine?
The InChIKey is UIZCOXSEVGIBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-14(15-3-2-8-19-13-15)20-16-6-11-21(12-7-16)17-4-9-18-10-5-17/h2-5,8-10,13-14,16,20H,6-7,11-12H2,1H3.
What are the key properties of 1-pyridin-4-yl-N-(1-pyridin-3-ylethyl)piperidin-4-amine?
1-pyridin-4-yl-N-(1-pyridin-3-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-3-ylethyl)piperidin-4-amine is sourced from PubChem (CID 43343785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).