N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine

C18H19N7 — CID 110269836

IUPACN-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
SMILESc1cnc(Nc2cccc(C3CCCN(c4cnccn4)C3)n2)nc1
InChIInChI=1S/C18H19N7/c1-5-15(23-16(6-1)24-18-21-7-3-8-22-18)14-4-2-11-25(13-14)17-12-19-9-10-20-17/h1,3,5-10,12,14H,2,4,11,13H2,(H,21,22,23,24)
InChIKeyYOOPIOFVFBXKPX-UHFFFAOYSA-N
MW333.40 g/mol
LogP2.79
Rot. Bonds4

About N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine

N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine (PubChem CID 110269836) has the molecular formula C18H19N7 and a molecular weight of 333.40 g/mol. Its IUPAC name is N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
PubChem CID110269836
Molecular FormulaC18H19N7
Molecular Weight333.40 g/mol
Exact Mass333.17
IUPAC NameN-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
SMILESc1cnc(Nc2cccc(C3CCCN(c4cnccn4)C3)n2)nc1
InChIInChI=1S/C18H19N7/c1-5-15(23-16(6-1)24-18-21-7-3-8-22-18)14-4-2-11-25(13-14)17-12-19-9-10-20-17/h1,3,5-10,12,14H,2,4,11,13H2,(H,21,22,23,24)
InChIKeyYOOPIOFVFBXKPX-UHFFFAOYSA-N
XLogP2.79
TPSA79.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-6-(1-pyrazin-2-ylpiperidin-3-yl)pyridin-2-amine
CID 110269026
2-[(3S)-3-pyridin-2-ylpiperidin-1-yl]pyrazine
CID 95817344
N-methyl-6-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]pyrazin-2-amine
CID 95840808
1-[(3S)-3-[6-(pyrimidin-2-ylamino)-2-pyridinyl]piperidin-1-yl]ethanone
CID 95835868
3-[6-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]-2-pyridinyl]propanoic acid
CID 95827209
4-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]-N-pyrimidin-5-ylpyrimidin-2-amine
CID 124946806
N-pyrazin-2-yl-6-(1-pyrimidin-2-ylpiperidin-3-yl)pyrazin-2-amine
CID 110094062
2-methyl-N-pyrimidin-2-yl-6-(1-pyrimidin-4-ylpiperidin-3-yl)pyrimidin-4-amine
CID 132764783
N-[6-[(3S)-1-[(2-methylphenyl)methyl]piperidin-3-yl]-2-pyridinyl]pyrimidin-2-amine
CID 95835954
N-[6-(1-cyclohexylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
CID 110093750
[(3S)-3-[6-(pyrazin-2-ylamino)-2-pyridinyl]piperidin-1-yl]-pyridin-2-ylmethanone
CID 124982023
N-methyl-6-[(3R)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]pyridin-2-amine
CID 95824516

Frequently Asked Questions

What is the IUPAC name of N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine?
The IUPAC name of N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine (CID 110269836) is N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine.
What is the SMILES notation for N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine?
The canonical SMILES for N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine is c1cnc(Nc2cccc(C3CCCN(c4cnccn4)C3)n2)nc1.
What is the InChIKey of N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine?
The InChIKey is YOOPIOFVFBXKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7/c1-5-15(23-16(6-1)24-18-21-7-3-8-22-18)14-4-2-11-25(13-14)17-12-19-9-10-20-17/h1,3,5-10,12,14H,2,4,11,13H2,(H,21,22,23,24).
What are the key properties of N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine?
N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine has a molecular weight of 333.40 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine is sourced from PubChem (CID 110269836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).