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

C15H20N6 — CID 110095069

IUPACN-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCNc1nccnc1CC1CCCN(c2ncccn2)C1
InChIInChI=1S/C15H20N6/c1-16-14-13(17-7-8-18-14)10-12-4-2-9-21(11-12)15-19-5-3-6-20-15/h3,5-8,12H,2,4,9-11H2,1H3,(H,16,18)
InChIKeyRYDAWTWUDXVDPJ-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.77
Rot. Bonds4

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

N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (PubChem CID 110095069) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
PubChem CID110095069
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCNc1nccnc1CC1CCCN(c2ncccn2)C1
InChIInChI=1S/C15H20N6/c1-16-14-13(17-7-8-18-14)10-12-4-2-9-21(11-12)15-19-5-3-6-20-15/h3,5-8,12H,2,4,9-11H2,1H3,(H,16,18)
InChIKeyRYDAWTWUDXVDPJ-UHFFFAOYSA-N
XLogP1.77
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095070
3-[(1-ethylsulfonylpiperidin-3-yl)methyl]-N-methylpyrazin-2-amine
CID 110113242
3-amino-1-[3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]propan-1-one
CID 110113301
N-methyl-3-[[(3R)-1-[(1-methylpyrrol-2-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 124959550
N-methyl-3-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 124988938
N-methyl-3-[[1-[(2-methylpyrazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113217
1-[(3R)-3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]-3-thiophen-2-ylpropan-1-one
CID 124991653
(2-ethoxy-3-pyridinyl)-[(3R)-3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]methanone
CID 124956924
2-(2-fluorophenyl)-1-[(3R)-3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]ethanone
CID 125003518
[3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 110113209
(4,4-difluorocyclohexyl)-[3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]methanone
CID 110113321
N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 124944814

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (CID 110095069) is N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is CNc1nccnc1CC1CCCN(c2ncccn2)C1.
What is the InChIKey of N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The InChIKey is RYDAWTWUDXVDPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-16-14-13(17-7-8-18-14)10-12-4-2-9-21(11-12)15-19-5-3-6-20-15/h3,5-8,12H,2,4,9-11H2,1H3,(H,16,18).
What are the key properties of N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine has a molecular weight of 284.37 g/mol, XLogP of 1.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 110095069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).