3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide

C17H28N4O2 — CID 122268315

IUPAC3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide
SMILESCCc1cnc(OC2CCCN(C(=O)NC(CC)CC)C2)nc1
InChIInChI=1S/C17H28N4O2/c1-4-13-10-18-16(19-11-13)23-15-8-7-9-21(12-15)17(22)20-14(5-2)6-3/h10-11,14-15H,4-9,12H2,1-3H3,(H,20,22)
InChIKeyZCWKYWFINFSLHV-UHFFFAOYSA-N
MW320.44 g/mol
LogP2.78
Rot. Bonds6

About 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide

3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide (PubChem CID 122268315) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide
PubChem CID122268315
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide
SMILESCCc1cnc(OC2CCCN(C(=O)NC(CC)CC)C2)nc1
InChIInChI=1S/C17H28N4O2/c1-4-13-10-18-16(19-11-13)23-15-8-7-9-21(12-15)17(22)20-14(5-2)6-3/h10-11,14-15H,4-9,12H2,1-3H3,(H,20,22)
InChIKeyZCWKYWFINFSLHV-UHFFFAOYSA-N
XLogP2.78
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carboxamide
CID 122268290
N-(2,6-difluorophenyl)-3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carboxamide
CID 122268310
4-[3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carbonyl]cyclohexan-1-one
CID 122268218
N-(3,4-dichlorophenyl)-3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carboxamide
CID 122268297
1-[3-(5-ethylpyrimidin-2-yl)oxypiperidin-1-yl]-2-phenylethanone
CID 122268069
1-[4-[3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carbonyl]phenyl]ethanone
CID 122268269
[3-(5-ethylpyrimidin-2-yl)oxypiperidin-1-yl]-pyrazin-2-ylmethanone
CID 122268128
(2,6-difluorophenyl)-[3-(5-ethylpyrimidin-2-yl)oxypiperidin-1-yl]methanone
CID 122268032
1-[3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carbonyl]imidazolidin-2-one
CID 122268349
N-[(3,4-dimethoxyphenyl)methyl]-3-(5-ethylpyrimidin-2-yl)oxypiperidine-1-carboxamide
CID 122268321
[3-(5-ethylpyrimidin-2-yl)oxypiperidin-1-yl]-(4-phenylphenyl)methanone
CID 122268048
[3-(5-ethylpyrimidin-2-yl)oxypiperidin-1-yl]-(5-hydroxy-3-pyridinyl)methanone
CID 122268274

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide?
The IUPAC name of 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide (CID 122268315) is 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide?
The canonical SMILES for 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide is CCc1cnc(OC2CCCN(C(=O)NC(CC)CC)C2)nc1.
What is the InChIKey of 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide?
The InChIKey is ZCWKYWFINFSLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-4-13-10-18-16(19-11-13)23-15-8-7-9-21(12-15)17(22)20-14(5-2)6-3/h10-11,14-15H,4-9,12H2,1-3H3,(H,20,22).
What are the key properties of 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide?
3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide has a molecular weight of 320.44 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethylpyrimidin-2-yl)oxy-N-pentan-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 122268315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).