2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine

C14H19N5 — CID 80787409

IUPAC2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine
SMILESCCCNc1cncc(N(C)Cc2cccnc2)n1
InChIInChI=1S/C14H19N5/c1-3-6-17-13-9-16-10-14(18-13)19(2)11-12-5-4-7-15-8-12/h4-5,7-10H,3,6,11H2,1-2H3,(H,17,18)
InChIKeyJIBQQGFFKZMKDO-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.33
Rot. Bonds6

About 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine

2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine (PubChem CID 80787409) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine
PubChem CID80787409
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC Name2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine
SMILESCCCNc1cncc(N(C)Cc2cccnc2)n1
InChIInChI=1S/C14H19N5/c1-3-6-17-13-9-16-10-14(18-13)19(2)11-12-5-4-7-15-8-12/h4-5,7-10H,3,6,11H2,1-2H3,(H,17,18)
InChIKeyJIBQQGFFKZMKDO-UHFFFAOYSA-N
XLogP2.33
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-[(4-fluorophenyl)methyl]-2-N-methyl-6-N-propylpyrazine-2,6-diamine
CID 80794812
5-N-methyl-3-N-propyl-5-N-(pyridin-3-ylmethyl)pyridine-3,5-diamine
CID 104533005
6-(chloromethyl)-N-methyl-N-(pyridin-3-ylmethyl)pyrazin-2-amine
CID 66467781
2-N-methyl-2-N-[(2-methylfuran-3-yl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80796320
6-N-ethyl-2-N-[(3-methoxyphenyl)methyl]-2-N-methylpyrazine-2,6-diamine
CID 78917983
4-N,5-dimethyl-2-N-propyl-4-N-(pyridin-3-ylmethyl)pyrimidine-2,4-diamine
CID 80787782
5-bromo-4-N-methyl-2-N-propyl-4-N-(pyridin-3-ylmethyl)pyrimidine-2,4-diamine
CID 80788051
6-methoxy-2-N-methyl-4-N-propyl-2-N-(pyridin-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80775435
2-N-methyl-2-N-(2-methylsulfanylethyl)-6-N-propylpyrazine-2,6-diamine
CID 112667733
6-N-ethyl-2-N-(2-pyridin-3-ylethyl)pyrazine-2,6-diamine
CID 78990149
1-methyl-3-propyl-1-(pyridin-3-ylmethyl)urea
CID 78786415
2-N-ethyl-2-N-phenyl-6-N-propylpyrazine-2,6-diamine
CID 80756431

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine (CID 80787409) is 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine is CCCNc1cncc(N(C)Cc2cccnc2)n1.
What is the InChIKey of 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine?
The InChIKey is JIBQQGFFKZMKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-3-6-17-13-9-16-10-14(18-13)19(2)11-12-5-4-7-15-8-12/h4-5,7-10H,3,6,11H2,1-2H3,(H,17,18).
What are the key properties of 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine?
2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine has a molecular weight of 257.34 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-N-propyl-2-N-(pyridin-3-ylmethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 80787409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).