2,5-dimethyl-3-propyl-4H-pyrimidine

C9H16N2 — CID 142076733

IUPAC2,5-dimethyl-3-propyl-4H-pyrimidine
SMILESCCCN1CC(C)=CN=C1C
InChIInChI=1S/C9H16N2/c1-4-5-11-7-8(2)6-10-9(11)3/h6H,4-5,7H2,1-3H3
InChIKeySFAOMORWKOBKEJ-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.03
Rot. Bonds2

About 2,5-dimethyl-3-propyl-4H-pyrimidine

2,5-dimethyl-3-propyl-4H-pyrimidine (PubChem CID 142076733) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,5-dimethyl-3-propyl-4H-pyrimidine.

Molecular Properties

Compound Name2,5-dimethyl-3-propyl-4H-pyrimidine
PubChem CID142076733
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name2,5-dimethyl-3-propyl-4H-pyrimidine
SMILESCCCN1CC(C)=CN=C1C
InChIInChI=1S/C9H16N2/c1-4-5-11-7-8(2)6-10-9(11)3/h6H,4-5,7H2,1-3H3
InChIKeySFAOMORWKOBKEJ-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,5-Trimethylpyrimidin-4-imine
CID 134868678
1,2,3,5-tetramethyl-4H-pyrimidin-3-ium
CID 66739127
2-methyl-3-propyl-4H-pyrimidine
CID 68059140
3,3-dimethyl-2-propyl-4H-pyrimidin-3-ium
CID 70223891
1,2,5-trimethyl-3-methylidene-4H-pyrimidine-1,3-diium
CID 90694123
2,3,5-trimethyl-4H-pyrimidine
CID 90695249
(Z)-3-amino-N-ethyl-N',2-dimethyl-N-propylprop-2-enimidamide
CID 118973186
1,2,3-triethyl-4H-pyrimidin-3-ium
CID 121295176
N'-methyl-N-(2-methylprop-1-enyl)-N-propylethanimidamide
CID 123174184
N-(2-methylprop-1-enyl)-1-pyrrolidin-1-ylbutan-1-imine
CID 134559554
ethene;1-(4-methylpiperazin-1-yl)-N-(2-methylprop-1-enyl)ethanimine
CID 142079946
5-butyl-2,3-dimethyl-4H-pyrimidine
CID 142120666

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-propyl-4H-pyrimidine?
The IUPAC name of 2,5-dimethyl-3-propyl-4H-pyrimidine (CID 142076733) is 2,5-dimethyl-3-propyl-4H-pyrimidine.
What is the SMILES notation for 2,5-dimethyl-3-propyl-4H-pyrimidine?
The canonical SMILES for 2,5-dimethyl-3-propyl-4H-pyrimidine is CCCN1CC(C)=CN=C1C.
What is the InChIKey of 2,5-dimethyl-3-propyl-4H-pyrimidine?
The InChIKey is SFAOMORWKOBKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-4-5-11-7-8(2)6-10-9(11)3/h6H,4-5,7H2,1-3H3.
What are the key properties of 2,5-dimethyl-3-propyl-4H-pyrimidine?
2,5-dimethyl-3-propyl-4H-pyrimidine has a molecular weight of 152.24 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-propyl-4H-pyrimidine is sourced from PubChem (CID 142076733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).