N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride

C16H22ClN5 — CID 71298941

IUPACN-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride
SMILESCl.c1cnc(Nc2cc(CCC3CCCNC3)ccn2)cn1
InChIInChI=1S/C16H21N5.ClH/c1-2-14(11-17-6-1)4-3-13-5-7-19-15(10-13)21-16-12-18-8-9-20-16;/h5,7-10,12,14,17H,1-4,6,11H2,(H,19,20,21);1H
InChIKeyHKCJUKUCPHSPTK-UHFFFAOYSA-N
MW319.84 g/mol
LogP2.97
Rot. Bonds5

About N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride

N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride (PubChem CID 71298941) has the molecular formula C16H22ClN5 and a molecular weight of 319.84 g/mol. Its IUPAC name is N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride.

Molecular Properties

Compound NameN-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride
PubChem CID71298941
Molecular FormulaC16H22ClN5
Molecular Weight319.84 g/mol
Exact Mass319.16
IUPAC NameN-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride
SMILESCl.c1cnc(Nc2cc(CCC3CCCNC3)ccn2)cn1
InChIInChI=1S/C16H21N5.ClH/c1-2-14(11-17-6-1)4-3-13-5-7-19-15(10-13)21-16-12-18-8-9-20-16;/h5,7-10,12,14,17H,1-4,6,11H2,(H,19,20,21);1H
InChIKeyHKCJUKUCPHSPTK-UHFFFAOYSA-N
XLogP2.97
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.84
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-piperidin-3-ylethyl)pyridin-2-amine;dihydrochloride
CID 167995844
(3S)-N,N-dimethyl-3-[2-[2-(pyrazin-2-ylamino)-4-pyridinyl]ethyl]piperidine-1-sulfonamide
CID 95838129
[3-[2-[2-(pyrazin-2-ylamino)-4-pyridinyl]ethyl]piperidin-1-yl]-pyridin-3-ylmethanone
CID 110267556
6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95816713
5-[(3S)-piperidin-3-yl]-N-pyrazin-2-ylpyrazin-2-amine
CID 124969984
4-(2-pyrrolidin-3-ylethyl)pyridine;dihydrochloride
CID 126845941
3-(2-piperidin-3-ylethoxy)pyridine;hydrochloride
CID 56830400
3-[2-(4-fluorophenyl)ethyl]piperidine;hydrochloride
CID 126844820
4-(2-pyrrolidin-3-ylethyl)pyridine
CID 83481928
2-[3-[(3R)-piperidin-3-yl]propoxy]pyrazine
CID 97178299
4-methyl-N-(2-piperidin-3-ylethyl)pyridin-2-amine
CID 63629904
6-(2-piperidin-3-ylethyl)-1H-benzimidazole
CID 116925639

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride?
The IUPAC name of N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride (CID 71298941) is N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride.
What is the SMILES notation for N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride?
The canonical SMILES for N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride is Cl.c1cnc(Nc2cc(CCC3CCCNC3)ccn2)cn1.
What is the InChIKey of N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride?
The InChIKey is HKCJUKUCPHSPTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5.ClH/c1-2-14(11-17-6-1)4-3-13-5-7-19-15(10-13)21-16-12-18-8-9-20-16;/h5,7-10,12,14,17H,1-4,6,11H2,(H,19,20,21);1H.
What are the key properties of N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride?
N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride has a molecular weight of 319.84 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-piperidin-3-ylethyl)-2-pyridinyl]pyrazin-2-amine;hydrochloride is sourced from PubChem (CID 71298941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).