2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine

C18H24N4 — CID 112879295

IUPAC2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)Nc1cc(N2CCCCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H24N4/c1-14(2)19-16-13-17(22-11-7-4-8-12-22)21-18(20-16)15-9-5-3-6-10-15/h3,5-6,9-10,13-14H,4,7-8,11-12H2,1-2H3,(H,19,20,21)
InChIKeyMQNORQMEDZDOIG-UHFFFAOYSA-N
MW296.42 g/mol
LogP3.95
Rot. Bonds4

About 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine

2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine (PubChem CID 112879295) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine
PubChem CID112879295
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)Nc1cc(N2CCCCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C18H24N4/c1-14(2)19-16-13-17(22-11-7-4-8-12-22)21-18(20-16)15-9-5-3-6-10-15/h3,5-6,9-10,13-14H,4,7-8,11-12H2,1-2H3,(H,19,20,21)
InChIKeyMQNORQMEDZDOIG-UHFFFAOYSA-N
XLogP3.95
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(azepan-1-yl)-N-butan-2-yl-2-phenylpyrimidin-4-amine
CID 112879898
N-butan-2-yl-2-phenyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 112879854
6-(azepan-1-yl)-N-(2-methylpropyl)-2-phenylpyrimidin-4-amine
CID 112879821
6-morpholin-4-yl-2-phenyl-N-(1-phenylethyl)pyrimidin-4-amine
CID 112880500
5-methyl-N-(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)-1,2-oxazol-3-amine
CID 112880152
1-[4-[(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)amino]phenyl]ethanone
CID 112880138
6-(azepan-1-yl)-2-phenyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 112881321
N-[(2-fluorophenyl)methyl]-2-phenyl-6-piperidin-1-ylpyrimidin-4-amine
CID 112880106
1-[3-[[6-(azepan-1-yl)-2-phenylpyrimidin-4-yl]amino]phenyl]ethanone
CID 112881688
N-(2,5-dimethoxyphenyl)-2-phenyl-6-piperidin-1-ylpyrimidin-4-amine
CID 112880134
3-[(2-phenyl-6-piperidin-1-ylpyrimidin-4-yl)amino]benzonitrile
CID 112880150
N-(furan-2-ylmethyl)-2-phenyl-6-piperidin-1-ylpyrimidin-4-amine
CID 112880103

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine (CID 112879295) is 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine is CC(C)Nc1cc(N2CCCCC2)nc(-c2ccccc2)n1.
What is the InChIKey of 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is MQNORQMEDZDOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c1-14(2)19-16-13-17(22-11-7-4-8-12-22)21-18(20-16)15-9-5-3-6-10-15/h3,5-6,9-10,13-14H,4,7-8,11-12H2,1-2H3,(H,19,20,21).
What are the key properties of 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine?
2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 296.42 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-piperidin-1-yl-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 112879295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).