4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine

C11H14N2 — CID 59622924

IUPAC4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine
SMILESCC(C)C1=CC=NC2=CC=CCN21
InChIInChI=1S/C11H14N2/c1-9(2)10-6-7-12-11-5-3-4-8-13(10)11/h3-7,9H,8H2,1-2H3
InChIKeyHCPWVMIXWLDBNU-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.32
Rot. Bonds1

About 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine

4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine (PubChem CID 59622924) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine
PubChem CID59622924
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine
SMILESCC(C)C1=CC=NC2=CC=CCN21
InChIInChI=1S/C11H14N2/c1-9(2)10-6-7-12-11-5-3-4-8-13(10)11/h3-7,9H,8H2,1-2H3
InChIKeyHCPWVMIXWLDBNU-UHFFFAOYSA-N
XLogP2.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9H-pyrimido[1,2-a]quinoline
CID 91449658
4-propan-2-yl-6H-pyrimido[1,6-a]pyrimidine
CID 59283470
7-Methyl-6-methylidenepyrido[1,2-a]pyrimidine
CID 59284286
1,2-Dimethyl-3a,7a-dihydropyrrolo[2,3-b]pyridine
CID 68048011
1-(2-Methylpropyl)-2,7-dihydroimidazo[4,5-c][1,5]naphthyridine
CID 70287047
2-Methyl-1-(2-methylpropyl)-2,7-dihydroimidazo[4,5-c][1,5]naphthyridine
CID 70288414
7-methyl-6H-1,7-naphthyridine
CID 85972581
7,9a-dihydro-6H-pyrido[1,2-a]pyrimidine
CID 118369222
9,9a-dihydro-6H-pyrido[1,2-a]pyrimidine
CID 118369228
6-methyl-1H-pyrido[1,2-c]pyrimidine
CID 142434040
4-but-1-en-2-yl-2-ethenyl-6H-pyrazino[1,2-a]pyrimidine;ethane
CID 143345847
5-[(1Z)-buta-1,3-dienyl]-6-ethenyl-1-propyl-2H-pyrimidine
CID 144168442

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine?
The IUPAC name of 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine (CID 59622924) is 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine is CC(C)C1=CC=NC2=CC=CCN21.
What is the InChIKey of 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine?
The InChIKey is HCPWVMIXWLDBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-9(2)10-6-7-12-11-5-3-4-8-13(10)11/h3-7,9H,8H2,1-2H3.
What are the key properties of 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine?
4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine has a molecular weight of 174.25 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-6H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 59622924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).