N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine

C18H19N7 — CID 110097846

IUPACN-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cnc(N2CCC(c3ccnc(Nc4cnccn4)c3)CC2)nc1
InChIInChI=1S/C18H19N7/c1-5-22-18(23-6-1)25-10-3-14(4-11-25)15-2-7-20-16(12-15)24-17-13-19-8-9-21-17/h1-2,5-9,12-14H,3-4,10-11H2,(H,20,21,24)
InChIKeyPJOVWFQUIYVOOB-UHFFFAOYSA-N
MW333.40 g/mol
LogP2.79
Rot. Bonds4

About N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine

N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine (PubChem CID 110097846) has the molecular formula C18H19N7 and a molecular weight of 333.40 g/mol. Its IUPAC name is N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
PubChem CID110097846
Molecular FormulaC18H19N7
Molecular Weight333.40 g/mol
Exact Mass333.17
IUPAC NameN-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine
SMILESc1cnc(N2CCC(c3ccnc(Nc4cnccn4)c3)CC2)nc1
InChIInChI=1S/C18H19N7/c1-5-22-18(23-6-1)25-10-3-14(4-11-25)15-2-7-20-16(12-15)24-17-13-19-8-9-21-17/h1-2,5-9,12-14H,3-4,10-11H2,(H,20,21,24)
InChIKeyPJOVWFQUIYVOOB-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-[6-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]-2-pyridinyl]pyrazin-2-amine
CID 95815305
N-[4-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-3-yl]-2-pyridinyl]pyrazin-2-amine
CID 110111773
N-pyrazin-2-yl-6-(1-pyrimidin-2-ylpiperidin-3-yl)pyrazin-2-amine
CID 110094062
N-[4-[1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]-2-pyridinyl]pyrazin-2-amine
CID 110111840
N-pyrazin-2-yl-6-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrimidin-4-amine
CID 110258979
N-(pyrazin-2-ylmethyl)-1-pyrimidin-2-ylpiperidin-4-amine
CID 62761801
N-[4-[1-[(3-methylimidazol-4-yl)methyl]piperidin-4-yl]-2-pyridinyl]pyrimidin-2-amine
CID 110097766
N-[4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 127245198
N-pyridin-2-yl-4-[(2S)-1-pyrimidin-2-ylpyrrolidin-2-yl]pyridin-2-amine
CID 124949904
N,N-dimethyl-2-[2-[2-(pyrazin-2-ylamino)-4-pyridinyl]pyrrolidin-1-yl]acetamide
CID 110097688
N,N-dimethyl-2-[(2R)-2-[2-(pyrazin-2-ylamino)-4-pyridinyl]pyrrolidin-1-yl]acetamide
CID 124971029
2-[(4-cyclopropyl-2-pyridinyl)amino]pyridine-4-carbonitrile
CID 129021795

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine (CID 110097846) is N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine is c1cnc(N2CCC(c3ccnc(Nc4cnccn4)c3)CC2)nc1.
What is the InChIKey of N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
The InChIKey is PJOVWFQUIYVOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7/c1-5-22-18(23-6-1)25-10-3-14(4-11-25)15-2-7-20-16(12-15)24-17-13-19-8-9-21-17/h1-2,5-9,12-14H,3-4,10-11H2,(H,20,21,24).
What are the key properties of N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine?
N-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-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-[4-(1-pyrimidin-2-ylpiperidin-4-yl)-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 110097846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).