ethane;4H-pyrido[1,2-a]pyrimidine

C10H14N2 — CID 142933435

IUPACethane;4H-pyrido[1,2-a]pyrimidine
SMILESC1=CC2=NC=CCN2C=C1.CC
InChIInChI=1S/C8H8N2.C2H6/c1-2-6-10-7-3-5-9-8(10)4-1;1-2/h1-6H,7H2;1-2H3
InChIKeyAKNVIJIZWZMJCZ-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.32
Rot. Bonds

About ethane;4H-pyrido[1,2-a]pyrimidine

ethane;4H-pyrido[1,2-a]pyrimidine (PubChem CID 142933435) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is ethane;4H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Nameethane;4H-pyrido[1,2-a]pyrimidine
PubChem CID142933435
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Nameethane;4H-pyrido[1,2-a]pyrimidine
SMILESC1=CC2=NC=CCN2C=C1.CC
InChIInChI=1S/C8H8N2.C2H6/c1-2-6-10-7-3-5-9-8(10)4-1;1-2/h1-6H,7H2;1-2H3
InChIKeyAKNVIJIZWZMJCZ-UHFFFAOYSA-N
XLogP2.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4H-pyrido[1,2-a]pyrimidine?
The IUPAC name of ethane;4H-pyrido[1,2-a]pyrimidine (CID 142933435) is ethane;4H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for ethane;4H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for ethane;4H-pyrido[1,2-a]pyrimidine is C1=CC2=NC=CCN2C=C1.CC.
What is the InChIKey of ethane;4H-pyrido[1,2-a]pyrimidine?
The InChIKey is AKNVIJIZWZMJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2.C2H6/c1-2-6-10-7-3-5-9-8(10)4-1;1-2/h1-6H,7H2;1-2H3.
What are the key properties of ethane;4H-pyrido[1,2-a]pyrimidine?
ethane;4H-pyrido[1,2-a]pyrimidine has a molecular weight of 162.24 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 142933435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).