2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide

C20H26N4O4 — CID 172661191

IUPAC2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide
SMILESCOC(C)C(=O)Nc1cc(C(=O)N2CCC(c3noc(C)n3)CC2)ccc1C
InChIInChI=1S/C20H26N4O4/c1-12-5-6-16(11-17(12)22-19(25)13(2)27-4)20(26)24-9-7-15(8-10-24)18-21-14(3)28-23-18/h5-6,11,13,15H,7-10H2,1-4H3,(H,22,25)
InChIKeyYAHBYMKQRDBYMM-UHFFFAOYSA-N
MW386.45 g/mol
LogP2.68
Rot. Bonds5

About 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide

2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide (PubChem CID 172661191) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide.

Molecular Properties

Compound Name2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide
PubChem CID172661191
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC Name2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide
SMILESCOC(C)C(=O)Nc1cc(C(=O)N2CCC(c3noc(C)n3)CC2)ccc1C
InChIInChI=1S/C20H26N4O4/c1-12-5-6-16(11-17(12)22-19(25)13(2)27-4)20(26)24-9-7-15(8-10-24)18-21-14(3)28-23-18/h5-6,11,13,15H,7-10H2,1-4H3,(H,22,25)
InChIKeyYAHBYMKQRDBYMM-UHFFFAOYSA-N
XLogP2.68
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2-cyclobutyloxy-4-pyridinyl)-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 75392914
N-cyclopropyl-3-(2-methoxypropanoylamino)-4-methylbenzamide
CID 47308191
1-[5-[4-(3-methoxyphenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-propan-2-ylurea
CID 68954757
methyl 4-[[2-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]propanoylamino]methyl]benzoate
CID 60614224
(3S)-N-[5-[(2-methoxyacetyl)amino]-2-methylphenyl]-3-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carboxamide
CID 97436643
(2-chloro-4-fluoro-5-methylphenyl)-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidin-1-yl]methanone
CID 167953199
1-[5-[4-(3-chlorophenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-propan-2-ylurea
CID 68953307
1-methyl-N-[2-methyl-5-[4-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine-1-carbonyl]phenyl]pyrrole-2-carboxamide
CID 172656764
N-[4-(dimethylcarbamoyl)phenyl]-3-(5-methyl-1,2,4-oxadiazol-3-yl)pyrrolidine-1-carboxamide
CID 136562477
2-[[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]carbamoylamino]-3-methylbutanamide
CID 91449961
N-[5-[4-(4-chlorophenoxy)piperidine-1-carbonyl]-2-methylphenyl]acetamide
CID 166281479
3-(5-methyl-1,2,4-oxadiazol-3-yl)-N-(5-phenyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 146138655

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide?
The IUPAC name of 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide (CID 172661191) is 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide.
What is the SMILES notation for 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide?
The canonical SMILES for 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide is COC(C)C(=O)Nc1cc(C(=O)N2CCC(c3noc(C)n3)CC2)ccc1C.
What is the InChIKey of 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide?
The InChIKey is YAHBYMKQRDBYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c1-12-5-6-16(11-17(12)22-19(25)13(2)27-4)20(26)24-9-7-15(8-10-24)18-21-14(3)28-23-18/h5-6,11,13,15H,7-10H2,1-4H3,(H,22,25).
What are the key properties of 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide?
2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide has a molecular weight of 386.45 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-methyl-5-[4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]phenyl]propanamide is sourced from PubChem (CID 172661191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).