7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one

C15H14ClN5O — CID 86774691

IUPAC7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(CN2CCn3ccnc3C2)nc2ccc(Cl)cn12
InChIInChI=1S/C15H14ClN5O/c16-11-1-2-13-18-12(7-15(22)21(13)8-11)9-19-5-6-20-4-3-17-14(20)10-19/h1-4,7-8H,5-6,9-10H2
InChIKeyDZVLCYSDUIOSHN-UHFFFAOYSA-N
MW315.76 g/mol
LogP1.56
Rot. Bonds2

About 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one

7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 86774691) has the molecular formula C15H14ClN5O and a molecular weight of 315.76 g/mol. Its IUPAC name is 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
PubChem CID86774691
Molecular FormulaC15H14ClN5O
Molecular Weight315.76 g/mol
Exact Mass315.09
IUPAC Name7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(CN2CCn3ccnc3C2)nc2ccc(Cl)cn12
InChIInChI=1S/C15H14ClN5O/c16-11-1-2-13-18-12(7-15(22)21(13)8-11)9-19-5-6-20-4-3-17-14(20)10-19/h1-4,7-8H,5-6,9-10H2
InChIKeyDZVLCYSDUIOSHN-UHFFFAOYSA-N
XLogP1.56
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one (CID 86774691) is 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one is O=c1cc(CN2CCn3ccnc3C2)nc2ccc(Cl)cn12.
What is the InChIKey of 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is DZVLCYSDUIOSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN5O/c16-11-1-2-13-18-12(7-15(22)21(13)8-11)9-19-5-6-20-4-3-17-14(20)10-19/h1-4,7-8H,5-6,9-10H2.
What are the key properties of 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one?
7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 315.76 g/mol, XLogP of 1.56, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 86774691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).