N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide

C15H16N4O2 — CID 107375415

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NC2CCOc3ccccc32)cn1
InChIInChI=1S/C15H16N4O2/c1-16-14-9-17-12(8-18-14)15(20)19-11-6-7-21-13-5-3-2-4-10(11)13/h2-5,8-9,11H,6-7H2,1H3,(H,16,18)(H,19,20)
InChIKeyHAJGRKIOKNPAEQ-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.77
Rot. Bonds3

About N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide

N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide (PubChem CID 107375415) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide
PubChem CID107375415
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide
SMILESCNc1cnc(C(=O)NC2CCOc3ccccc32)cn1
InChIInChI=1S/C15H16N4O2/c1-16-14-9-17-12(8-18-14)15(20)19-11-6-7-21-13-5-3-2-4-10(11)13/h2-5,8-9,11H,6-7H2,1H3,(H,16,18)(H,19,20)
InChIKeyHAJGRKIOKNPAEQ-UHFFFAOYSA-N
XLogP1.77
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dihydro-2H-chromen-4-yl)-2-(methylamino)pyridine-4-carboxamide
CID 62365931
5-cyano-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2-carboxamide
CID 63719488
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-5-methyl-1H-pyrazole-3-carboxamide
CID 94526998
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-6-oxo-1H-pyridazine-3-carboxamide
CID 30602468
N-cyclobutyl-5-(methylamino)pyrazine-2-carboxamide
CID 107375423
N-(3,4-dihydro-2H-chromen-4-yl)pyridine-4-carboxamide
CID 18164392
5-cyclopropyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1H-pyrazole-3-carboxamide
CID 94179713
N-(7-methoxy-3,4-dihydro-2H-chromen-4-yl)-4,5-dimethylpyridine-2-carboxamide
CID 136564096
4-amino-N-(3,4-dihydro-2H-chromen-4-yl)benzamide
CID 43709544
N-(3,4-dihydro-2H-chromen-4-yl)-2-fluorobenzamide
CID 18193126
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-methylthiophene-2-carboxamide
CID 31284395
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxamide
CID 31339166

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide (CID 107375415) is N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide is CNc1cnc(C(=O)NC2CCOc3ccccc32)cn1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide?
The InChIKey is HAJGRKIOKNPAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-16-14-9-17-12(8-18-14)15(20)19-11-6-7-21-13-5-3-2-4-10(11)13/h2-5,8-9,11H,6-7H2,1H3,(H,16,18)(H,19,20).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide?
N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-5-(methylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107375415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).