4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride

C12H21Cl2N3 — CID 167995844

IUPAC4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride
SMILESCl.Cl.Nc1cc(CCC2CCCNC2)ccn1
InChIInChI=1S/C12H19N3.2ClH/c13-12-8-10(5-7-15-12)3-4-11-2-1-6-14-9-11;;/h5,7-8,11,14H,1-4,6,9H2,(H2,13,15);2*1H
InChIKeyADGKBQPQUWSDMR-UHFFFAOYSA-N
MW278.23 g/mol
LogP2.44
Rot. Bonds3

About 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride

4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride (PubChem CID 167995844) has the molecular formula C12H21Cl2N3 and a molecular weight of 278.23 g/mol. Its IUPAC name is 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride.

Molecular Properties

Compound Name4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride
PubChem CID167995844
Molecular FormulaC12H21Cl2N3
Molecular Weight278.23 g/mol
Exact Mass277.11
IUPAC Name4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride
SMILESCl.Cl.Nc1cc(CCC2CCCNC2)ccn1
InChIInChI=1S/C12H19N3.2ClH/c13-12-8-10(5-7-15-12)3-4-11-2-1-6-14-9-11;;/h5,7-8,11,14H,1-4,6,9H2,(H2,13,15);2*1H
InChIKeyADGKBQPQUWSDMR-UHFFFAOYSA-N
XLogP2.44
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride
CID 71298941
3-[2-(4-fluorophenyl)ethyl]piperidine;hydrochloride
CID 126844820
2-(2-amino-4-pyridinyl)-1-piperidin-3-ylethanone
CID 116548022
6-(2-piperidin-3-ylethyl)-1H-benzimidazole
CID 116925639
4-(2-pyrrolidin-3-ylethyl)pyridine;dihydrochloride
CID 126845941
4-(2-piperidin-3-ylethyl)benzenethiol
CID 142937615
4-(cycloheptylmethyl)pyridin-2-amine
CID 82923791
4-(2-pyrrolidin-3-ylethyl)pyridine
CID 83481928
2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
CID 139490801
2-bromo-4-(3-piperidin-3-ylpropoxymethyl)pyridine;hydrochloride
CID 71636545
6-(2-piperidin-3-ylethyl)-3,4-dihydro-2H-1,4-benzothiazine
CID 116999243
3-[2-(1H-imidazol-2-yl)ethyl]piperidine
CID 84732247

Frequently Asked Questions

What is the IUPAC name of 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride?
The IUPAC name of 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride (CID 167995844) is 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride.
What is the SMILES notation for 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride?
The canonical SMILES for 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride is Cl.Cl.Nc1cc(CCC2CCCNC2)ccn1.
What is the InChIKey of 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride?
The InChIKey is ADGKBQPQUWSDMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3.2ClH/c13-12-8-10(5-7-15-12)3-4-11-2-1-6-14-9-11;;/h5,7-8,11,14H,1-4,6,9H2,(H2,13,15);2*1H.
What are the key properties of 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride?
4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride has a molecular weight of 278.23 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride is sourced from PubChem (CID 167995844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).