N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide

C19H24N4O — CID 109273948

IUPACN-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cnc(NCCCc2ccccc2)cn1
InChIInChI=1S/C19H24N4O/c24-19(23-16-10-4-5-11-16)17-13-22-18(14-21-17)20-12-6-9-15-7-2-1-3-8-15/h1-3,7-8,13-14,16H,4-6,9-12H2,(H,20,22)(H,23,24)
InChIKeyWUMZFWUUWDNBTL-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.19
Rot. Bonds7

About N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide

N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide (PubChem CID 109273948) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide
PubChem CID109273948
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC NameN-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cnc(NCCCc2ccccc2)cn1
InChIInChI=1S/C19H24N4O/c24-19(23-16-10-4-5-11-16)17-13-22-18(14-21-17)20-12-6-9-15-7-2-1-3-8-15/h1-3,7-8,13-14,16H,4-6,9-12H2,(H,20,22)(H,23,24)
InChIKeyWUMZFWUUWDNBTL-UHFFFAOYSA-N
XLogP3.19
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-tert-butyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide
CID 109287052
N-cyclohexyl-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109274670
5-(3-phenylpropylamino)-N-prop-2-enylpyrazine-2-carboxamide
CID 109272017
N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271032
N-(4-tert-butylphenyl)-5-(3-phenylpropylamino)pyrazine-2-carboxamide
CID 109287084
N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109274671
N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109273887
N-cyclopentyl-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 1447863
N-cyclopentyl-5-[(2-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109273905
N-cyclopropyl-5-[2-(2-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109271592
N-[(2-methylphenyl)methyl]-5-(3-phenylpropylamino)pyrazine-2-carboxamide
CID 109279989
N-[(2-chlorophenyl)methyl]-5-(3-phenylpropylamino)pyrazine-2-carboxamide
CID 109281812

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide (CID 109273948) is N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide is O=C(NC1CCCC1)c1cnc(NCCCc2ccccc2)cn1.
What is the InChIKey of N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide?
The InChIKey is WUMZFWUUWDNBTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c24-19(23-16-10-4-5-11-16)17-13-22-18(14-21-17)20-12-6-9-15-7-2-1-3-8-15/h1-3,7-8,13-14,16H,4-6,9-12H2,(H,20,22)(H,23,24).
What are the key properties of N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide?
N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 3.19, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-(3-phenylpropylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109273948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).