3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine

C10H12N2 — CID 143545409

IUPAC3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine
SMILESCC1=CN2C=C(C)CN=C2C=C1
InChIInChI=1S/C10H12N2/c1-8-3-4-10-11-5-9(2)7-12(10)6-8/h3-4,6-7H,5H2,1-2H3
InChIKeyPGEJWLPPSLELJY-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.08
Rot. Bonds

About 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine

3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine (PubChem CID 143545409) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine
PubChem CID143545409
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine
SMILESCC1=CN2C=C(C)CN=C2C=C1
InChIInChI=1S/C10H12N2/c1-8-3-4-10-11-5-9(2)7-12(10)6-8/h3-4,6-7H,5H2,1-2H3
InChIKeyPGEJWLPPSLELJY-UHFFFAOYSA-N
XLogP2.08
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,7-Dimethyl-2,2-bis(trifluoromethyl)pyrido[1,2-a][1,3,5]triazine
CID 17390122
1-ethenyl-N-methyl-5-(trifluoromethyl)pyridin-2-imine
CID 146477817
7-butyl-4H-pyrido[1,2-a]pyrimidine
CID 20348005
magnesium;N,N,4-trimethyl-3H-pyridin-3-id-6-amine;bromide
CID 22249050
N,1,4-trimethylpyridin-2-imine
CID 23387651
6-Methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 45087578
2,3-Dimethyl-4-methylidenepyrido[1,2-a]pyrimidine
CID 54479691
1H-pyrido[2,1-b]quinazoline
CID 57105532
3H-pyrido[2,1-b]quinazoline
CID 57137694
6-ethyl-2H-imidazo[1,2-a]pyridin-4-ium
CID 57589463
2-hydroxy-N-methylisoquinolin-3-imine
CID 57733005
4-tert-butyl-N,1-dimethylpyridin-2-imine
CID 59485522

Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine?
The IUPAC name of 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine (CID 143545409) is 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine is CC1=CN2C=C(C)CN=C2C=C1.
What is the InChIKey of 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine?
The InChIKey is PGEJWLPPSLELJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-8-3-4-10-11-5-9(2)7-12(10)6-8/h3-4,6-7H,5H2,1-2H3.
What are the key properties of 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine?
3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine has a molecular weight of 160.22 g/mol, XLogP of 2.08, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-2H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 143545409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).