5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide

C15H26N4O2 — CID 109276273

IUPAC5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(NCCCOC)cn1
InChIInChI=1S/C15H26N4O2/c1-4-8-19(9-5-2)15(20)13-11-18-14(12-17-13)16-7-6-10-21-3/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyAHEFGQDSCXOLAU-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.19
Rot. Bonds10

About 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide

5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide (PubChem CID 109276273) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide
PubChem CID109276273
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(NCCCOC)cn1
InChIInChI=1S/C15H26N4O2/c1-4-8-19(9-5-2)15(20)13-11-18-14(12-17-13)16-7-6-10-21-3/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyAHEFGQDSCXOLAU-UHFFFAOYSA-N
XLogP2.19
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(dimethylamino)ethyl]-5-(3-methoxypropylamino)pyrazine-2-carboxamide
CID 109276206
N-butyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374046
N-propyl-5-(propylamino)-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide
CID 107374760
N-(2-methoxyethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109270966
5-[2-(4-chlorophenyl)ethylamino]-N,N-dipropylpyrazine-2-carboxamide
CID 109285830
N-(cyclopropylmethyl)-N-propyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374839
N-(1,1-dioxothiolan-3-yl)-5-(3-methoxypropylamino)-N-methylpyrazine-2-carboxamide
CID 109276240
N-[3-(dimethylamino)propyl]-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109275842
N-butyl-N-methyl-5-(pentylamino)pyrazine-2-carboxamide
CID 109288114
methyl 5-(butylamino)pyrazine-2-carboxylate
CID 68565370
N-(4-ethylphenyl)-5-(3-methoxypropylamino)pyrazine-2-carboxamide
CID 109276292
6-(2-methoxyethylamino)-N,N-dipropylpyridazine-3-carboxamide
CID 109113786

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide?
The IUPAC name of 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide (CID 109276273) is 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide?
The canonical SMILES for 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide is CCCN(CCC)C(=O)c1cnc(NCCCOC)cn1.
What is the InChIKey of 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide?
The InChIKey is AHEFGQDSCXOLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-4-8-19(9-5-2)15(20)13-11-18-14(12-17-13)16-7-6-10-21-3/h11-12H,4-10H2,1-3H3,(H,16,18).
What are the key properties of 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide?
5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 2.19, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxypropylamino)-N,N-dipropylpyrazine-2-carboxamide is sourced from PubChem (CID 109276273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).