N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide

C15H28N6O — CID 109277733

IUPACN-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide
SMILESCN(C)CCCNC(=O)c1cnc(NCCCN(C)C)cn1
InChIInChI=1S/C15H28N6O/c1-20(2)9-5-7-16-14-12-18-13(11-19-14)15(22)17-8-6-10-21(3)4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,22)
InChIKeySCBMTYFHTAQRNH-UHFFFAOYSA-N
MW308.43 g/mol
LogP0.52
Rot. Bonds10

About N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide

N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide (PubChem CID 109277733) has the molecular formula C15H28N6O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide
PubChem CID109277733
Molecular FormulaC15H28N6O
Molecular Weight308.43 g/mol
Exact Mass308.23
IUPAC NameN-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide
SMILESCN(C)CCCNC(=O)c1cnc(NCCCN(C)C)cn1
InChIInChI=1S/C15H28N6O/c1-20(2)9-5-7-16-14-12-18-13(11-19-14)15(22)17-8-6-10-21(3)4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,22)
InChIKeySCBMTYFHTAQRNH-UHFFFAOYSA-N
XLogP0.52
TPSA73.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyrazine-2-carboxamide
CID 109277279
N-[3-(dimethylamino)propyl]-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109275842
5-[3-(dimethylamino)propylamino]-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272741
N-[2-(dimethylamino)ethyl]-5-(3-methoxypropylamino)pyrazine-2-carboxamide
CID 109276206
5-[3-(dimethylamino)propylamino]-N-propan-2-ylpyrazine-2-carboxamide
CID 109271171
5-(benzylamino)-N-[3-(dimethylamino)propyl]pyrazine-2-carboxamide
CID 109277739
5-[3-(dimethylamino)propylamino]-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109277924
N-[3-(dimethylamino)propyl]-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109277760
5-[3-(dimethylamino)propylamino]-N-[(4-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 109277919
5-[2-(dimethylamino)ethylamino]-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272739
5-[3-(dimethylamino)propylamino]-N-(4-ethylphenyl)pyrazine-2-carboxamide
CID 109277983
N-(2-chlorophenyl)-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide
CID 109277995

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide (CID 109277733) is N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide is CN(C)CCCNC(=O)c1cnc(NCCCN(C)C)cn1.
What is the InChIKey of N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide?
The InChIKey is SCBMTYFHTAQRNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6O/c1-20(2)9-5-7-16-14-12-18-13(11-19-14)15(22)17-8-6-10-21(3)4/h11-12H,5-10H2,1-4H3,(H,16,19)(H,17,22).
What are the key properties of N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide?
N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide has a molecular weight of 308.43 g/mol, XLogP of 0.52, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-5-[3-(dimethylamino)propylamino]pyrazine-2-carboxamide is sourced from PubChem (CID 109277733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).