N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide

C14H24N4O — CID 109272804

IUPACN-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide
SMILESCCCCCNc1cnc(C(=O)NCC(C)C)cn1
InChIInChI=1S/C14H24N4O/c1-4-5-6-7-15-13-10-16-12(9-17-13)14(19)18-8-11(2)3/h9-11H,4-8H2,1-3H3,(H,15,17)(H,18,19)
InChIKeyOEVNBIOKRHRNGN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.46
Rot. Bonds8

About N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide

N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide (PubChem CID 109272804) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide
PubChem CID109272804
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide
SMILESCCCCCNc1cnc(C(=O)NCC(C)C)cn1
InChIInChI=1S/C14H24N4O/c1-4-5-6-7-15-13-10-16-12(9-17-13)14(19)18-8-11(2)3/h9-11H,4-8H2,1-3H3,(H,15,17)(H,18,19)
InChIKeyOEVNBIOKRHRNGN-UHFFFAOYSA-N
XLogP2.46
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.46
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

5-(butylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272533
5-[3-(dimethylamino)propylamino]-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272741
N-butyl-5-(2-methylpropylamino)pyrazine-2-carboxamide
CID 109272339
5-[2-(dimethylamino)ethylamino]-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272739
5-(propylamino)-N-(2,3,3-trimethylbutyl)pyrazine-2-carboxamide
CID 107376665
N-(4-methylpentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375562
N-butyl-N-methyl-5-(pentylamino)pyrazine-2-carboxamide
CID 109288114
5-[(4-methylphenyl)methylamino]-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272750
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyrazine-2-carboxamide
CID 107377215
5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
CID 109181275
5-(butylamino)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109272569
N-butyl-N-methyl-5-(2-methylpropylamino)pyrazine-2-carboxamide
CID 109272998

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide (CID 109272804) is N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide is CCCCCNc1cnc(C(=O)NCC(C)C)cn1.
What is the InChIKey of N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide?
The InChIKey is OEVNBIOKRHRNGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-5-6-7-15-13-10-16-12(9-17-13)14(19)18-8-11(2)3/h9-11H,4-8H2,1-3H3,(H,15,17)(H,18,19).
What are the key properties of N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide?
N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-5-(pentylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109272804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).