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

C17H22N4 — CID 43761318

IUPAC1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
SMILESc1ccc(CCNC2CCN(c3ccccn3)CC2)nc1
InChIInChI=1S/C17H22N4/c1-3-10-18-15(5-1)7-12-19-16-8-13-21(14-9-16)17-6-2-4-11-20-17/h1-6,10-11,16,19H,7-9,12-14H2
InChIKeyXMRLBIAGXVDGHK-UHFFFAOYSA-N
MW282.39 g/mol
LogP2.28
Rot. Bonds5

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

1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine (PubChem CID 43761318) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
PubChem CID43761318
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
SMILESc1ccc(CCNC2CCN(c3ccccn3)CC2)nc1
InChIInChI=1S/C17H22N4/c1-3-10-18-15(5-1)7-12-19-16-8-13-21(14-9-16)17-6-2-4-11-20-17/h1-6,10-11,16,19H,7-9,12-14H2
InChIKeyXMRLBIAGXVDGHK-UHFFFAOYSA-N
XLogP2.28
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 103775425
N-(2-methylsulfanylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 63983974
N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-1-pyridin-2-ylpiperidin-4-amine
CID 63332224
N',N'-diethyl-N-(1-pyridin-2-ylpiperidin-4-yl)ethane-1,2-diamine
CID 43761755
2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethylurea
CID 83111405
N-(3-methylsulfanylpropyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675357
N-(2-pyridin-2-ylethyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43761376
4-N-(2-pyridin-2-ylethyl)cyclohexane-1,4-diamine
CID 79724278
N-[2-[(1-pyridin-2-ylpiperidin-4-yl)amino]ethyl]cyclopropanecarboxamide
CID 115706396
N-(5-methylhexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 81338605
N-(3-methoxy-3-methylbutyl)-1-pyridin-2-ylpiperidin-4-amine
CID 106675135

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The IUPAC name of 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine (CID 43761318) is 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine is c1ccc(CCNC2CCN(c3ccccn3)CC2)nc1.
What is the InChIKey of 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The InChIKey is XMRLBIAGXVDGHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-3-10-18-15(5-1)7-12-19-16-8-13-21(14-9-16)17-6-2-4-11-20-17/h1-6,10-11,16,19H,7-9,12-14H2.
What are the key properties of 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine is sourced from PubChem (CID 43761318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).