N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine

C19H21N7 — CID 125000666

IUPACN-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine
SMILESCc1cccc(Nc2nccnc2[C@H]2CCCN(c3ccncn3)C2)n1
InChIInChI=1S/C19H21N7/c1-14-4-2-6-16(24-14)25-19-18(21-9-10-22-19)15-5-3-11-26(12-15)17-7-8-20-13-23-17/h2,4,6-10,13,15H,3,5,11-12H2,1H3,(H,22,24,25)/t15-/m0/s1
InChIKeyRXIVSHLZVRUDCH-HNNXBMFYSA-N
MW347.43 g/mol
LogP3.10
Rot. Bonds4

About N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine

N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine (PubChem CID 125000666) has the molecular formula C19H21N7 and a molecular weight of 347.43 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine
PubChem CID125000666
Molecular FormulaC19H21N7
Molecular Weight347.43 g/mol
Exact Mass347.19
IUPAC NameN-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine
SMILESCc1cccc(Nc2nccnc2[C@H]2CCCN(c3ccncn3)C2)n1
InChIInChI=1S/C19H21N7/c1-14-4-2-6-16(24-14)25-19-18(21-9-10-22-19)15-5-3-11-26(12-15)17-7-8-20-13-23-17/h2,4,6-10,13,15H,3,5,11-12H2,1H3,(H,22,24,25)/t15-/m0/s1
InChIKeyRXIVSHLZVRUDCH-HNNXBMFYSA-N
XLogP3.10
TPSA79.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

2-methyl-N-pyrimidin-2-yl-6-(1-pyrimidin-4-ylpiperidin-3-yl)pyrimidin-4-amine
CID 132764783
[(3R)-3-[3-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 124998772
1-[4-[3-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95821987
N-(6-methyl-2-pyridinyl)-3-[(2R)-1-pyrimidin-2-ylpyrrolidin-2-yl]pyrazin-2-amine
CID 95844631
4-(1-pyridin-2-ylpiperidin-3-yl)pyrimidine
CID 122602482
2-methyl-1-[(2S)-2-[3-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]pyrrolidin-1-yl]propan-1-one
CID 95844524
2-[4-[3-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]piperidin-1-yl]acetamide
CID 95822092
N,N-dimethyl-2-[2-[3-[(6-methyl-2-pyridinyl)amino]pyrazin-2-yl]pyrrolidin-1-yl]acetamide
CID 110270567
5-methyl-7-(1-pyrimidin-4-ylpiperidin-3-yl)imidazo[1,5-c]pyrimidine
CID 110131586
4-methyl-2-[(3S)-1-pyrimidin-4-ylpyrrolidin-3-yl]pyrimidine
CID 95841796
4-methyl-2-[(3R)-1-pyrimidin-4-ylpyrrolidin-3-yl]pyrimidine
CID 95841795
N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
CID 110269836

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine?
The IUPAC name of N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine (CID 125000666) is N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine is Cc1cccc(Nc2nccnc2[C@H]2CCCN(c3ccncn3)C2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine?
The InChIKey is RXIVSHLZVRUDCH-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H21N7/c1-14-4-2-6-16(24-14)25-19-18(21-9-10-22-19)15-5-3-11-26(12-15)17-7-8-20-13-23-17/h2,4,6-10,13,15H,3,5,11-12H2,1H3,(H,22,24,25)/t15-/m0/s1.
What are the key properties of N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine?
N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine has a molecular weight of 347.43 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-3-[(3S)-1-pyrimidin-4-ylpiperidin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 125000666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).