4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine

C15H27N5 — CID 80792256

IUPAC4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(N2CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H27N5/c1-5-6-16-15-17-13(4)11-14(18-15)20-9-7-19(8-10-20)12(2)3/h11-12H,5-10H2,1-4H3,(H,16,17,18)
InChIKeyFPKHRJLAMYLSDA-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.14
Rot. Bonds5

About 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine

4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine (PubChem CID 80792256) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine
PubChem CID80792256
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(N2CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H27N5/c1-5-6-16-15-17-13(4)11-14(18-15)20-9-7-19(8-10-20)12(2)3/h11-12H,5-10H2,1-4H3,(H,16,17,18)
InChIKeyFPKHRJLAMYLSDA-UHFFFAOYSA-N
XLogP2.14
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-6-piperazin-1-yl-N-propylpyrimidin-2-amine
CID 80837570
4-methyl-N-(3-methylbutyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 112913833
4-(3,5-dimethylpiperidin-1-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80766891
4-[2-(butylamino)-6-methylpyrimidin-4-yl]piperazine-1-carbaldehyde
CID 112908286
4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80836941
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-6-methyl-N-propylpyrimidin-2-amine
CID 80831413
4-methyl-N-pentyl-6-(4-phenylpiperazin-1-yl)pyrimidin-2-amine
CID 112922177
N-butyl-4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine
CID 112908336
N-[2-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]ethyl]propane-1-sulfonamide
CID 121075385
6-piperidin-1-yl-2-N,4-N-dipropylpyrimidine-2,4-diamine
CID 70171641
4-[4-(3-chlorophenyl)piperazin-1-yl]-6-methyl-N-(3-methylbutyl)pyrimidin-2-amine
CID 112923605
4-(4-ethylpiperazin-1-yl)-6-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112913275

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine?
The IUPAC name of 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine (CID 80792256) is 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine is CCCNc1nc(C)cc(N2CCN(C(C)C)CC2)n1.
What is the InChIKey of 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine?
The InChIKey is FPKHRJLAMYLSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-5-6-16-15-17-13(4)11-14(18-15)20-9-7-19(8-10-20)12(2)3/h11-12H,5-10H2,1-4H3,(H,16,17,18).
What are the key properties of 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine?
4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine has a molecular weight of 277.42 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylpyrimidin-2-amine is sourced from PubChem (CID 80792256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).