4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine

C16H20N4 — CID 141014641

IUPAC4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine
SMILESCc1ccnc(NC2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C16H20N4/c1-13-7-10-17-16(18-13)19-14-8-11-20(12-9-14)15-5-3-2-4-6-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,17,18,19)
InChIKeyWUOQIJPJTVZLJT-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.87
Rot. Bonds3

About 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine

4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine (PubChem CID 141014641) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine
PubChem CID141014641
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine
SMILESCc1ccnc(NC2CCN(c3ccccc3)CC2)n1
InChIInChI=1S/C16H20N4/c1-13-7-10-17-16(18-13)19-14-8-11-20(12-9-14)15-5-3-2-4-6-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,17,18,19)
InChIKeyWUOQIJPJTVZLJT-UHFFFAOYSA-N
XLogP2.87
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(5-methyl-1H-pyrazol-4-yl)-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine
CID 59564767
4-methyl-N-piperidin-4-ylpyrimidin-2-amine
CID 59744254
4-methyl-N-[1-(5-methyl-1,3-thiazol-2-yl)pyrrolidin-3-yl]pyrimidin-2-amine
CID 171993129
N-cyclopentyl-4-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 58227252
N-(1-phenylpiperidin-4-yl)-1,3-thiazol-2-amine
CID 113226644
N-(3-methoxycyclopentyl)-4-methylpyrimidin-2-amine
CID 103081989
[2-(cyclopropylamino)-6-methylpyrimidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 109319693
N-[1-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]piperidin-4-yl]pyrimidin-2-amine
CID 56872592
N-[(6-methyl-2-pyridinyl)methyl]-1-phenylpiperidin-4-amine
CID 103778062
N-cyclopentyl-4-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-2-amine
CID 112884384
N-[1-[4-(difluoromethoxy)phenyl]piperidin-3-yl]-4-methylpyrimidin-2-amine
CID 133325736
2,3,5,6-tetrafluoro-N-(1-phenylpiperidin-4-yl)pyridin-4-amine
CID 133371653

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine?
The IUPAC name of 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine (CID 141014641) is 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine is Cc1ccnc(NC2CCN(c3ccccc3)CC2)n1.
What is the InChIKey of 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine?
The InChIKey is WUOQIJPJTVZLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-13-7-10-17-16(18-13)19-14-8-11-20(12-9-14)15-5-3-2-4-6-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,17,18,19).
What are the key properties of 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine?
4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine has a molecular weight of 268.36 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-phenylpiperidin-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 141014641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).