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

C15H20N6 — CID 171995944

IUPACN-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine
SMILESCN(c1ncccn1)C1CCCN(Cc2cnccn2)C1
InChIInChI=1S/C15H20N6/c1-20(15-18-5-3-6-19-15)14-4-2-9-21(12-14)11-13-10-16-7-8-17-13/h3,5-8,10,14H,2,4,9,11-12H2,1H3
InChIKeyQDGYPZJATDWMKV-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.37
Rot. Bonds4

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

N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine (PubChem CID 171995944) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine
PubChem CID171995944
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine
SMILESCN(c1ncccn1)C1CCCN(Cc2cnccn2)C1
InChIInChI=1S/C15H20N6/c1-20(15-18-5-3-6-19-15)14-4-2-9-21(12-14)11-13-10-16-7-8-17-13/h3,5-8,10,14H,2,4,9,11-12H2,1H3
InChIKeyQDGYPZJATDWMKV-UHFFFAOYSA-N
XLogP1.37
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]ethanol
CID 62356299
(3S)-1-(pyrazin-2-ylmethyl)pyrrolidin-3-amine
CID 71644033
N-[1-[(2-methoxy-4-pyridinyl)methyl]piperidin-3-yl]-N-methylpyrimidin-2-amine
CID 171995780
1-(pyrazin-2-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 71644418
1-(pyrazin-2-ylmethyl)pyrrolidin-3-ol
CID 62917165
N-[1-[(2-bromophenyl)methyl]piperidin-3-yl]-N,4-dimethylpyrimidin-2-amine
CID 171998484
(3S)-1-(pyridin-2-ylmethyl)piperidin-3-amine
CID 39221497
N,4-dimethyl-N-[1-[(1-methyltriazol-4-yl)methyl]piperidin-3-yl]pyrimidin-2-amine
CID 171995291
4-N-[1-[(5-bromo-2-pyridinyl)methyl]piperidin-3-yl]-2-N,2-N,4-N-trimethylpyrimidine-2,4-diamine
CID 172903582
2-N-[1-[(2-bromophenyl)methyl]piperidin-3-yl]-2-N,4-N,4-N-trimethylpyrimidine-2,4-diamine
CID 171998805
2-N,2-N,4-N-trimethyl-4-N-[1-(naphthalen-1-ylmethyl)piperidin-3-yl]pyrimidine-2,4-diamine
CID 175651595
5-bromo-N-methyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrimidin-2-amine
CID 171328148

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine?
The IUPAC name of N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine (CID 171995944) is N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine.
What is the SMILES notation for N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine?
The canonical SMILES for N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine is CN(c1ncccn1)C1CCCN(Cc2cnccn2)C1.
What is the InChIKey of N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine?
The InChIKey is QDGYPZJATDWMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-20(15-18-5-3-6-19-15)14-4-2-9-21(12-14)11-13-10-16-7-8-17-13/h3,5-8,10,14H,2,4,9,11-12H2,1H3.
What are the key properties of N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine?
N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine has a molecular weight of 284.37 g/mol, XLogP of 1.37, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 171995944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).