4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride

C18H25ClN4 — CID 24761619

IUPAC4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride
SMILESCCCc1nc(C)cc(N2CCN(c3ccccc3)CC2)n1.Cl
InChIInChI=1S/C18H24N4.ClH/c1-3-7-17-19-15(2)14-18(20-17)22-12-10-21(11-13-22)16-8-5-4-6-9-16;/h4-6,8-9,14H,3,7,10-13H2,1-2H3;1H
InChIKeyVYICMYRFSPZQQX-UHFFFAOYSA-N
MW332.88 g/mol
LogP3.49
Rot. Bonds4

About 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride

4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride (PubChem CID 24761619) has the molecular formula C18H25ClN4 and a molecular weight of 332.88 g/mol. Its IUPAC name is 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride.

Molecular Properties

Compound Name4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride
PubChem CID24761619
Molecular FormulaC18H25ClN4
Molecular Weight332.88 g/mol
Exact Mass332.18
IUPAC Name4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride
SMILESCCCc1nc(C)cc(N2CCN(c3ccccc3)CC2)n1.Cl
InChIInChI=1S/C18H24N4.ClH/c1-3-7-17-19-15(2)14-18(20-17)22-12-10-21(11-13-22)16-8-5-4-6-9-16;/h4-6,8-9,14H,3,7,10-13H2,1-2H3;1H
InChIKeyVYICMYRFSPZQQX-UHFFFAOYSA-N
XLogP3.49
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-Methyl-1-piperazinyl)-2-phenylquinazoline
CID 454717
2-Chloro-5-fluoro-4-(4-phenylpiperazin-1-yl)pyrimidine
CID 1911255
4-(4-Methylpiperazin-1-yl)-6-phenylpyrimidin-2-amine
CID 25129523
4-[2-Amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile
CID 25130235
2-(4-Methylpiperazin-1-yl)quinazolin-4-amine
CID 1403136
2-[4-(4-Fluorophenyl)piperazin-1-yl]-4,6-dimethylpyrimidine
CID 3165129
N4-benzyl-6-methyl-N2-phenyl-pyrimidine-2,4-diamine
CID 5276763
2-N-benzyl-4-N-butyl-6-methylpyrimidine-2,4-diamine
CID 659917
[6-Methyl-2-(phenylamino)pyrimidin-4-yl]phenylamine
CID 673737
2-(Pyridin-2-yl)pyrimidin-4-amine
CID 12403616
6-[(N-methylanilino)methyl]pyrido[3,2-d]pyrimidine-2,4-diamine
CID 462103
N6-methyl-N6-phenyl-pyrido[3,2-d]pyrimidine-2,4,6-triamine
CID 476043

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride?
The IUPAC name of 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride (CID 24761619) is 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride.
What is the SMILES notation for 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride?
The canonical SMILES for 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride is CCCc1nc(C)cc(N2CCN(c3ccccc3)CC2)n1.Cl.
What is the InChIKey of 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride?
The InChIKey is VYICMYRFSPZQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4.ClH/c1-3-7-17-19-15(2)14-18(20-17)22-12-10-21(11-13-22)16-8-5-4-6-9-16;/h4-6,8-9,14H,3,7,10-13H2,1-2H3;1H.
What are the key properties of 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride?
4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 3.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(4-phenylpiperazin-1-yl)-2-propylpyrimidine;hydrochloride is sourced from PubChem (CID 24761619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).