N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide

C16H18N6O — CID 53192926

IUPACN-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
SMILESO=C(NC1CCN(c2ncnc3c2CCC3)C1)c1cnccn1
InChIInChI=1S/C16H18N6O/c23-16(14-8-17-5-6-18-14)21-11-4-7-22(9-11)15-12-2-1-3-13(12)19-10-20-15/h5-6,8,10-11H,1-4,7,9H2,(H,21,23)
InChIKeyNPYHYMTXEDAUEC-UHFFFAOYSA-N
MW310.36 g/mol
LogP0.76
Rot. Bonds3

About N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide

N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide (PubChem CID 53192926) has the molecular formula C16H18N6O and a molecular weight of 310.36 g/mol. Its IUPAC name is N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
PubChem CID53192926
Molecular FormulaC16H18N6O
Molecular Weight310.36 g/mol
Exact Mass310.15
IUPAC NameN-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide
SMILESO=C(NC1CCN(c2ncnc3c2CCC3)C1)c1cnccn1
InChIInChI=1S/C16H18N6O/c23-16(14-8-17-5-6-18-14)21-11-4-7-22(9-11)15-12-2-1-3-13(12)19-10-20-15/h5-6,8,10-11H,1-4,7,9H2,(H,21,23)
InChIKeyNPYHYMTXEDAUEC-UHFFFAOYSA-N
XLogP0.76
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide with MolForge

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Related Compounds

[2-amino-4-(butylamino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-pyrazin-2-ylmethanone
CID 71696044
[2-amino-4-(butylamino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-(5-methylpyrazin-2-yl)methanone
CID 145988392
1-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]-N-isobutyl-1H-1,2,3-triazole-4-carboxamide
CID 56722083
N-cyclopropyl-1-[1-(6-cyclopropylpyrimidin-4-yl)piperidin-4-yl]-1H-1,2,3-triazole-4-carboxamide
CID 56723590
2-methyl-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-4-propan-2-ylpyrimidine-5-carboxamide
CID 72134602
2-methyl-4-propan-2-yl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 72134603
4-ethyl-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 72149706
[4-[Ethyl(methyl)amino]-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl]-pyrazin-2-ylmethanone
CID 97381464
[4-[1-(Cyclopropylmethyl)piperidin-4-yl]imidazo[1,5-a]pyrimidin-8-yl]-pyrrolidin-1-ylmethanone
CID 97447681
[4-(1-Propan-2-ylpiperidin-4-yl)imidazo[1,5-a]pyrimidin-8-yl]-pyrrolidin-1-ylmethanone
CID 97526939
N-[1-(Pyridin-3-YL)ethyl]-5H,6H,7H,8H-imidazo[1,2-A]pyridine-2-carboxamide
CID 53167913
N-{5H,6H,7H-Cyclopenta[D]pyrimidin-4-YL}-1-(pyrazine-2-carbonyl)pyrrolidin-3-amine
CID 53192969

Frequently Asked Questions

What is the IUPAC name of N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide?
The IUPAC name of N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide (CID 53192926) is N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide is O=C(NC1CCN(c2ncnc3c2CCC3)C1)c1cnccn1.
What is the InChIKey of N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide?
The InChIKey is NPYHYMTXEDAUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O/c23-16(14-8-17-5-6-18-14)21-11-4-7-22(9-11)15-12-2-1-3-13(12)19-10-20-15/h5-6,8,10-11H,1-4,7,9H2,(H,21,23).
What are the key properties of N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide?
N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide has a molecular weight of 310.36 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)pyrrolidin-3-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 53192926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).