N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide

C15H24N4O — CID 109271032

IUPACN-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NC2CCCCCC2)cn1
InChIInChI=1S/C15H24N4O/c1-2-9-16-14-11-17-13(10-18-14)15(20)19-12-7-5-3-4-6-8-12/h10-12H,2-9H2,1H3,(H,16,18)(H,19,20)
InChIKeySUQRMGRQKCAFFS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.75
Rot. Bonds5

About N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide

N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide (PubChem CID 109271032) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
PubChem CID109271032
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NC2CCCCCC2)cn1
InChIInChI=1S/C15H24N4O/c1-2-9-16-14-11-17-13(10-18-14)15(20)19-12-7-5-3-4-6-8-12/h10-12H,2-9H2,1H3,(H,16,18)(H,19,20)
InChIKeySUQRMGRQKCAFFS-UHFFFAOYSA-N
XLogP2.75
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-(2-methoxyethylamino)pyrazine-2-carboxamide
CID 109273887
N-(2-cyclohexylethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374667
N-(2,2-dimethylcyclopentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376214
N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274884
N-(2,4-dimethylcyclohexyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375780
N-(3-cyclopentylpropyl)-5-(propylamino)pyrazine-2-carboxamide
CID 106015585
N-cyclohexyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374221
N-cyclohexyl-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109274670
N-cyclobutyl-5-(methylamino)pyrazine-2-carboxamide
CID 107375423
N-cycloheptyl-5-[2-(cyclohexen-1-yl)ethylamino]pyrazine-2-carboxamide
CID 109275561
N-cyclohexyl-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109274671

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide?
The IUPAC name of N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide (CID 109271032) is N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide is CCCNc1cnc(C(=O)NC2CCCCCC2)cn1.
What is the InChIKey of N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide?
The InChIKey is SUQRMGRQKCAFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-9-16-14-11-17-13(10-18-14)15(20)19-12-7-5-3-4-6-8-12/h10-12H,2-9H2,1H3,(H,16,18)(H,19,20).
What are the key properties of N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide?
N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-5-(propylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109271032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).