1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide

C19H24N4O — CID 95082439

IUPAC1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide
SMILESCc1ccnc(N2CCC(C(=O)N[C@H](C)c3ccccc3)CC2)n1
InChIInChI=1S/C19H24N4O/c1-14-8-11-20-19(21-14)23-12-9-17(10-13-23)18(24)22-15(2)16-6-4-3-5-7-16/h3-8,11,15,17H,9-10,12-13H2,1-2H3,(H,22,24)/t15-/m1/s1
InChIKeyDQLRZZHYTHYNTO-OAHLLOKOSA-N
MW324.43 g/mol
LogP2.88
Rot. Bonds4

About 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide

1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide (PubChem CID 95082439) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide
PubChem CID95082439
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide
SMILESCc1ccnc(N2CCC(C(=O)N[C@H](C)c3ccccc3)CC2)n1
InChIInChI=1S/C19H24N4O/c1-14-8-11-20-19(21-14)23-12-9-17(10-13-23)18(24)22-15(2)16-6-4-3-5-7-16/h3-8,11,15,17H,9-10,12-13H2,1-2H3,(H,22,24)/t15-/m1/s1
InChIKeyDQLRZZHYTHYNTO-OAHLLOKOSA-N
XLogP2.88
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-phenylethyl)-1-(2-pyrrolidin-1-ylpyrimidin-5-yl)piperidine-4-carboxamide
CID 53146134
1-(2-morpholin-4-ylpyrimidin-5-yl)-N-(1-phenylethyl)piperidine-4-carboxamide
CID 53146248
N-[(2-methylphenyl)methyl]-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide
CID 53102218
1-N,4-N-bis[(1S)-1-phenylethyl]cyclohexane-1,4-dicarboxamide
CID 40636599
N-[3-(azepan-1-yl)butyl]-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide
CID 53102221
1-(4-acetamido-3-methyl-1-phenylpyrazol-5-yl)-N-(1-phenylethyl)piperidine-4-carboxamide
CID 46358506
1-[3-methyl-1-phenyl-4-(propanoylamino)pyrazol-5-yl]-N-[(1S)-1-phenylethyl]piperidine-4-carboxamide
CID 92876422
1-(2-methylpropanoyl)-N-(1-phenylethyl)piperidine-4-carboxamide
CID 113004076
1-(4-methylpyrimidin-2-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
CID 3697521
1-(4-methylpyrimidin-2-yl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 3590836
1-[4-(2-chloroanilino)pyrimidin-2-yl]-N-propan-2-ylpiperidine-4-carboxamide
CID 134797703
N-[1-(1-ethylbenzimidazol-2-yl)ethyl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 86858410

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide?
The IUPAC name of 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide (CID 95082439) is 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide is Cc1ccnc(N2CCC(C(=O)N[C@H](C)c3ccccc3)CC2)n1.
What is the InChIKey of 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide?
The InChIKey is DQLRZZHYTHYNTO-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N4O/c1-14-8-11-20-19(21-14)23-12-9-17(10-13-23)18(24)22-15(2)16-6-4-3-5-7-16/h3-8,11,15,17H,9-10,12-13H2,1-2H3,(H,22,24)/t15-/m1/s1.
What are the key properties of 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide?
1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpyrimidin-2-yl)-N-[(1R)-1-phenylethyl]piperidine-4-carboxamide is sourced from PubChem (CID 95082439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).