4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine

C17H24N4 — CID 112879230

IUPAC4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(N(CC)CC)nc(-c2ccccc2)n1
InChIInChI=1S/C17H24N4/c1-4-12-18-15-13-16(21(5-2)6-3)20-17(19-15)14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3,(H,18,19,20)
InChIKeyCBIDBVVKCBFZNH-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.81
Rot. Bonds7

About 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine

4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine (PubChem CID 112879230) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
PubChem CID112879230
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(N(CC)CC)nc(-c2ccccc2)n1
InChIInChI=1S/C17H24N4/c1-4-12-18-15-13-16(21(5-2)6-3)20-17(19-15)14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3,(H,18,19,20)
InChIKeyCBIDBVVKCBFZNH-UHFFFAOYSA-N
XLogP3.81
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,4-N-diethyl-6-N-(2-methylpropyl)-2-phenylpyrimidine-4,6-diamine
CID 112879814
4-N,4-N-diethyl-6-N-[2-(4-methoxyphenoxy)ethyl]-2-phenylpyrimidine-4,6-diamine
CID 112881558
4-N-pentyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879234
6-ethyl-2-phenyl-N-propylpyrimidin-4-amine
CID 62192699
N,N-diethyl-2,6-diphenylpyrimidin-4-amine
CID 2057498
4-N-benzyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879191
6-N-[4-(dimethylamino)phenyl]-4-N,4-N-diethyl-2-phenylpyrimidine-4,6-diamine
CID 112881588
4-N-cyclopropyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879169
6-chloro-N,N-diethyl-2-phenylpyrimidin-4-amine
CID 796090
N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
CID 112881584
4-N-butan-2-yl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879173
N-ethyl-6-hydrazinyl-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine
CID 115916099

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine (CID 112879230) is 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine is CCCNc1cc(N(CC)CC)nc(-c2ccccc2)n1.
What is the InChIKey of 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine?
The InChIKey is CBIDBVVKCBFZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-4-12-18-15-13-16(21(5-2)6-3)20-17(19-15)14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3,(H,18,19,20).
What are the key properties of 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine?
4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine has a molecular weight of 284.41 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 112879230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).