2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine

C11H16N2 — CID 141053134

IUPAC2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
SMILESCCCC1CCN2C=CC=CC2=N1
InChIInChI=1S/C11H16N2/c1-2-5-10-7-9-13-8-4-3-6-11(13)12-10/h3-4,6,8,10H,2,5,7,9H2,1H3
InChIKeyBRGATHYKKZZIAJ-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.34
Rot. Bonds2

About 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine

2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine (PubChem CID 141053134) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
PubChem CID141053134
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
SMILESCCCC1CCN2C=CC=CC2=N1
InChIInChI=1S/C11H16N2/c1-2-5-10-7-9-13-8-4-3-6-11(13)12-10/h3-4,6,8,10H,2,5,7,9H2,1H3
InChIKeyBRGATHYKKZZIAJ-UHFFFAOYSA-N
XLogP2.34
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-Dihydro-2h-pyrido[1,2-a]pyrimidine
CID 21111582
2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 91528254
2-(fluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 141053132
N,1-di(propan-2-yl)pyridin-2-imine
CID 20601372
1-(1-Methylpiperidin-4-yl)pyridin-2-imine
CID 89135049
(1-Pentyl-2-pyridinylidene)cyanamide
CID 134495227
2-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 141053130
ethane;N-methyl-1-propan-2-ylpyridin-2-imine
CID 178051432
ethane;4-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 178051578
4-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 178051579
ethane;N-methyl-1-propan-2-ylpyridin-2-imine
CID 178051695
6-Methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 71390294

Frequently Asked Questions

What is the IUPAC name of 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The IUPAC name of 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine (CID 141053134) is 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine is CCCC1CCN2C=CC=CC2=N1.
What is the InChIKey of 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The InChIKey is BRGATHYKKZZIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-2-5-10-7-9-13-8-4-3-6-11(13)12-10/h3-4,6,8,10H,2,5,7,9H2,1H3.
What are the key properties of 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine has a molecular weight of 176.26 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 141053134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).