2-propylpyrimidine-4,6-diamine

C7H12N4 — CID 67304918

IUPAC2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(N)n1
InChIInChI=1S/C7H12N4/c1-2-3-7-10-5(8)4-6(9)11-7/h4H,2-3H2,1H3,(H4,8,9,10,11)
InChIKeyAIJCHQBAZLSUIH-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.59
Rot. Bonds2

About 2-propylpyrimidine-4,6-diamine

2-propylpyrimidine-4,6-diamine (PubChem CID 67304918) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-propylpyrimidine-4,6-diamine
PubChem CID67304918
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(N)n1
InChIInChI=1S/C7H12N4/c1-2-3-7-10-5(8)4-6(9)11-7/h4H,2-3H2,1H3,(H4,8,9,10,11)
InChIKeyAIJCHQBAZLSUIH-UHFFFAOYSA-N
XLogP0.59
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80947336
6-(1-methylpyrazol-3-yl)-2-propylpyrimidin-4-amine
CID 103132092
6-hexoxy-2-propylpyrimidin-4-amine
CID 80949907
6-pentylsulfanyl-2-propylpyrimidin-4-amine
CID 107765305
2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
CID 80955354
4-N-cyclopropyl-2-propylpyrimidine-4,6-diamine
CID 80945616
6-cyclopentylsulfanyl-2-propylpyrimidin-4-amine
CID 80946943
2-(6-chloro-5-methyl-2-propylpyrimidin-4-yl)sulfanylpyrimidine-4,6-diamine
CID 80978525
4-N-decyl-2-propylpyrimidine-4,6-diamine
CID 80943780
4-N-methyl-4-N-(2-methylpropyl)-2-propylpyrimidine-4,6-diamine
CID 80954780
3-[(6-amino-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 80954273
2-[2-(dimethylamino)ethyl]-6-propylpyrimidin-4-amine
CID 115346978

Frequently Asked Questions

What is the IUPAC name of 2-propylpyrimidine-4,6-diamine?
The IUPAC name of 2-propylpyrimidine-4,6-diamine (CID 67304918) is 2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 2-propylpyrimidine-4,6-diamine is CCCc1nc(N)cc(N)n1.
What is the InChIKey of 2-propylpyrimidine-4,6-diamine?
The InChIKey is AIJCHQBAZLSUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-2-3-7-10-5(8)4-6(9)11-7/h4H,2-3H2,1H3,(H4,8,9,10,11).
What are the key properties of 2-propylpyrimidine-4,6-diamine?
2-propylpyrimidine-4,6-diamine has a molecular weight of 152.20 g/mol, XLogP of 0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 67304918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).