2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine

C17H23N5 — CID 133439337

IUPAC2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine
SMILESC=C(C)CN(C)c1nc2cccnc2nc1N(C)CC(=C)C
InChIInChI=1S/C17H23N5/c1-12(2)10-21(5)16-17(22(6)11-13(3)4)20-15-14(19-16)8-7-9-18-15/h7-9H,1,3,10-11H2,2,4-6H3
InChIKeyCTQBNVORHDRWDE-UHFFFAOYSA-N
MW297.41 g/mol
LogP3.05
Rot. Bonds6

About 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine

2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine (PubChem CID 133439337) has the molecular formula C17H23N5 and a molecular weight of 297.41 g/mol. Its IUPAC name is 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine
PubChem CID133439337
Molecular FormulaC17H23N5
Molecular Weight297.41 g/mol
Exact Mass297.20
IUPAC Name2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine
SMILESC=C(C)CN(C)c1nc2cccnc2nc1N(C)CC(=C)C
InChIInChI=1S/C17H23N5/c1-12(2)10-21(5)16-17(22(6)11-13(3)4)20-15-14(19-16)8-7-9-18-15/h7-9H,1,3,10-11H2,2,4-6H3
InChIKeyCTQBNVORHDRWDE-UHFFFAOYSA-N
XLogP3.05
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,3-dimethyl-N-(2-methylprop-2-enyl)quinoxalin-2-amine
CID 133439230
3-N-methyl-3-N-(2-methylprop-2-enyl)quinoxaline-2,3-diamine
CID 102987357
2-N,2-N-dimethylpyrido[2,3-b]pyrazine-2,3-diamine
CID 45115760
2,3-diiodopyrido[2,3-b]pyrazine
CID 163873901
phenazine;pyrido[3,2-b]quinoxaline
CID 134346125
4-(aminomethyl)-N-methyl-N-(2-methylprop-2-enyl)isoquinolin-1-amine
CID 106776889
2-N,3-N-dimethylpyrido[2,3-b]pyrazine-2,3-diamine
CID 57351034
N-methyl-N-(2-methylprop-2-enyl)-5-nitroquinolin-8-amine
CID 133439131
ethane;6,9,15,17,22-pentazapentacyclo[12.8.0.02,7.08,13.016,21]docosa-1(22),2(7),3,5,8(13),9,11,14,16(21),17,19-undecaene
CID 145351041
7-bromo-N-[(2E)-2,4-dimethylpenta-2,4-dienyl]-N-methylquinolin-8-amine
CID 142548955
3-fluoro-N-methyl-N-(2-methylprop-2-enyl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 105390409
2,3-bis(4-methoxyphenyl)pyrido[2,3-b]pyrazine
CID 22166291

Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine?
The IUPAC name of 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine (CID 133439337) is 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine.
What is the SMILES notation for 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine?
The canonical SMILES for 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine is C=C(C)CN(C)c1nc2cccnc2nc1N(C)CC(=C)C.
What is the InChIKey of 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine?
The InChIKey is CTQBNVORHDRWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5/c1-12(2)10-21(5)16-17(22(6)11-13(3)4)20-15-14(19-16)8-7-9-18-15/h7-9H,1,3,10-11H2,2,4-6H3.
What are the key properties of 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine?
2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine has a molecular weight of 297.41 g/mol, XLogP of 3.05, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-dimethyl-2-N,3-N-bis(2-methylprop-2-enyl)pyrido[2,3-b]pyrazine-2,3-diamine is sourced from PubChem (CID 133439337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).