N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide

C15H26N4O — CID 107375250

IUPACN-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)N(CC(C)C)C(C)C)cn1
InChIInChI=1S/C15H26N4O/c1-6-7-16-14-9-17-13(8-18-14)15(20)19(12(4)5)10-11(2)3/h8-9,11-12H,6-7,10H2,1-5H3,(H,16,18)
InChIKeyPFNCGFDHHMAQIV-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.81
Rot. Bonds7

About N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide

N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide (PubChem CID 107375250) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide
PubChem CID107375250
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)N(CC(C)C)C(C)C)cn1
InChIInChI=1S/C15H26N4O/c1-6-7-16-14-9-17-13(8-18-14)15(20)19(12(4)5)10-11(2)3/h8-9,11-12H,6-7,10H2,1-5H3,(H,16,18)
InChIKeyPFNCGFDHHMAQIV-UHFFFAOYSA-N
XLogP2.81
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylpentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375562
N-ethyl-5-(methylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107374443
N-butyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374046
N-(cyclopropylmethyl)-5-(ethylamino)-N-propan-2-ylpyrazine-2-carboxamide
CID 107375257
N-methyl-N-(2-methylsulfonylethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376210
5-(propylamino)-N-(2,3,3-trimethylbutyl)pyrazine-2-carboxamide
CID 107376665
N-methyl-N-phenyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271049
5-(butylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272533
N-cyclohexyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374221
N-propyl-5-(propylamino)-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide
CID 107374760
N-(5-hydroxypentyl)-N-methyl-5-(propylamino)pyrazine-2-carboxamide
CID 107377361
5-(methylamino)-N,N-bis(2-methylpropyl)pyrazine-2-carboxamide
CID 107374736

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide (CID 107375250) is N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide is CCCNc1cnc(C(=O)N(CC(C)C)C(C)C)cn1.
What is the InChIKey of N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide?
The InChIKey is PFNCGFDHHMAQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-6-7-16-14-9-17-13(8-18-14)15(20)19(12(4)5)10-11(2)3/h8-9,11-12H,6-7,10H2,1-5H3,(H,16,18).
What are the key properties of N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide?
N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-N-propan-2-yl-5-(propylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107375250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).