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

C18H23N3 — CID 103775425

IUPAC1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
SMILESc1ccc(N2CCC(NCCc3ccccn3)CC2)cc1
InChIInChI=1S/C18H23N3/c1-2-7-18(8-3-1)21-14-10-17(11-15-21)20-13-9-16-6-4-5-12-19-16/h1-8,12,17,20H,9-11,13-15H2
InChIKeyHBCMYPOBLCMNDC-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.88
Rot. Bonds5

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

1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine (PubChem CID 103775425) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
PubChem CID103775425
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
SMILESc1ccc(N2CCC(NCCc3ccccn3)CC2)cc1
InChIInChI=1S/C18H23N3/c1-2-7-18(8-3-1)21-14-10-17(11-15-21)20-13-9-16-6-4-5-12-19-16/h1-8,12,17,20H,9-11,13-15H2
InChIKeyHBCMYPOBLCMNDC-UHFFFAOYSA-N
XLogP2.88
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 43761318
1-methyl-3-[4-[4-(2-pyridin-2-ylethylamino)piperidin-1-yl]phenyl]imidazolidin-2-one
CID 31054711
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-phenylethyl)-1-pyridin-2-ylpiperidin-4-amine
CID 43675384
1-[2-(4-fluorophenyl)ethyl]-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 75382354
3-(2-pyridin-2-ylethylamino)cyclohexane-1-carboxylic acid
CID 63043512
N-(3-cyclopropylpropyl)-1-phenylpiperidin-4-amine
CID 103902375
N-(3,3-dimethylbutyl)-1-phenylpiperidin-4-amine
CID 103779062
N'-[1-(pyridin-2-ylmethyl)piperidin-4-yl]ethane-1,2-diamine
CID 142667116
N-[(3-methyl-2-pyridinyl)methyl]-1-phenylpiperidin-4-amine
CID 103782068
2-(4-phenylpiperazin-1-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 42859124

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The IUPAC name of 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine (CID 103775425) is 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine is c1ccc(N2CCC(NCCc3ccccn3)CC2)cc1.
What is the InChIKey of 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
The InChIKey is HBCMYPOBLCMNDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-2-7-18(8-3-1)21-14-10-17(11-15-21)20-13-9-16-6-4-5-12-19-16/h1-8,12,17,20H,9-11,13-15H2.
What are the key properties of 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine?
1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(2-pyridin-2-ylethyl)piperidin-4-amine is sourced from PubChem (CID 103775425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).