2,2-dimethylpyrido[1,2-a]pyrimidine;ethane

C12H18N2 — CID 142063286

IUPAC2,2-dimethylpyrido[1,2-a]pyrimidine;ethane
SMILESCC.CC1(C)C=CN2C=CC=CC2=N1
InChIInChI=1S/C10H12N2.C2H6/c1-10(2)6-8-12-7-4-3-5-9(12)11-10;1-2/h3-8H,1-2H3;1-2H3
InChIKeyNLVKBBVYTNMIGK-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.10
Rot. Bonds

About 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane

2,2-dimethylpyrido[1,2-a]pyrimidine;ethane (PubChem CID 142063286) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane.

Molecular Properties

Compound Name2,2-dimethylpyrido[1,2-a]pyrimidine;ethane
PubChem CID142063286
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2,2-dimethylpyrido[1,2-a]pyrimidine;ethane
SMILESCC.CC1(C)C=CN2C=CC=CC2=N1
InChIInChI=1S/C10H12N2.C2H6/c1-10(2)6-8-12-7-4-3-5-9(12)11-10;1-2/h3-8H,1-2H3;1-2H3
InChIKeyNLVKBBVYTNMIGK-UHFFFAOYSA-N
XLogP3.10
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2h-Pyrido-[1,2-a]pyrimidine
CID 20222720
4-Methyl-4h-pyrido[1,2-a]pyrimidine
CID 129791993
N,1,4-trimethylpyridin-2-imine
CID 23387651
2,3-Dimethyl-4-methylidenepyrido[1,2-a]pyrimidine
CID 54479691
3H-pyrido[2,1-b]quinazoline
CID 57137694
2-Methyl-4-methylidenepyrido[1,2-a]pyrimidine
CID 58148025
6-methyl-4H-pyrido[1,2-a]pyrimidine
CID 89183225
2-Ethyl-2,7-dimethylpyrimido[1,2-a]azocine
CID 91186655
2-ethenyl-N-methylisoquinolin-3-imine
CID 118303833
1-ethenyl-N,5-dimethylpyridin-2-imine
CID 122691861
1-ethenyl-N,4-dimethylpyridin-2-imine
CID 122691863
2,2-Dimethylpyrimido[1,2-c]pyrimidine
CID 130207580

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane?
The IUPAC name of 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane (CID 142063286) is 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane.
What is the SMILES notation for 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane?
The canonical SMILES for 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane is CC.CC1(C)C=CN2C=CC=CC2=N1.
What is the InChIKey of 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane?
The InChIKey is NLVKBBVYTNMIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2.C2H6/c1-10(2)6-8-12-7-4-3-5-9(12)11-10;1-2/h3-8H,1-2H3;1-2H3.
What are the key properties of 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane?
2,2-dimethylpyrido[1,2-a]pyrimidine;ethane has a molecular weight of 190.29 g/mol, XLogP of 3.10, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpyrido[1,2-a]pyrimidine;ethane is sourced from PubChem (CID 142063286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).