1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide

C22H32N2O3 — CID 126793039

IUPAC1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide
SMILESCOCCC1(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)CCC1
InChIInChI=1S/C22H32N2O3/c1-16-7-12-24(13-8-16)20(25)18-5-6-19(17(2)15-18)23-21(26)22(9-4-10-22)11-14-27-3/h5-6,15-16H,4,7-14H2,1-3H3,(H,23,26)
InChIKeyFQOHZJVKSZMCPM-UHFFFAOYSA-N
MW372.51 g/mol
LogP4.01
Rot. Bonds6

About 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide

1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide (PubChem CID 126793039) has the molecular formula C22H32N2O3 and a molecular weight of 372.51 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide
PubChem CID126793039
Molecular FormulaC22H32N2O3
Molecular Weight372.51 g/mol
Exact Mass372.24
IUPAC Name1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide
SMILESCOCCC1(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)CCC1
InChIInChI=1S/C22H32N2O3/c1-16-7-12-24(13-8-16)20(25)18-5-6-19(17(2)15-18)23-21(26)22(9-4-10-22)11-14-27-3/h5-6,15-16H,4,7-14H2,1-3H3,(H,23,26)
InChIKeyFQOHZJVKSZMCPM-UHFFFAOYSA-N
XLogP4.01
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide with MolForge

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Related Compounds

4-amino-3-methoxy-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]butanamide;hydrochloride
CID 120588215
1-(3-methoxypropyl)-3-[2-methyl-4-[(3R)-3-methylpiperidine-1-carbonyl]phenyl]urea
CID 95266911
(2S,5R)-5-(aminomethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]oxolane-2-carboxamide
CID 120786380
2-hydroxy-2-methyl-3-[[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]carbamoylamino]propanoic acid
CID 122077058
[3-methyl-4-(propylamino)phenyl]-(3-methylpyrrolidin-1-yl)methanone
CID 63213608
3-[[1-(2-ethoxyethyl)cyclobutanecarbonyl]amino]-4-methylbenzoic acid
CID 120522310
(4,4-dimethylazepan-1-yl)-(4-hydrazinyl-3-methylphenyl)methanone
CID 65286838
2-[4-(2-methoxyethoxy)anilino]-N-[3-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54822272
N-[3-(2-methoxyethoxy)phenyl]-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843222
(4-hydroxypiperidin-1-yl)-[3-methyl-4-(methylamino)phenyl]methanone
CID 63210549
[3-methyl-4-[[1-[(3R)-3-methyl-1,1-dioxothiolan-3-yl]pyrazol-4-yl]methylamino]phenyl]-(4-methylpiperidin-1-yl)methanone
CID 100708569
N-(2-methoxy-5-methylphenyl)-4-(4-methylpiperidine-1-carbonyl)benzamide
CID 109044952

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide (CID 126793039) is 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide is COCCC1(C(=O)Nc2ccc(C(=O)N3CCC(C)CC3)cc2C)CCC1.
What is the InChIKey of 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide?
The InChIKey is FQOHZJVKSZMCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O3/c1-16-7-12-24(13-8-16)20(25)18-5-6-19(17(2)15-18)23-21(26)22(9-4-10-22)11-14-27-3/h5-6,15-16H,4,7-14H2,1-3H3,(H,23,26).
What are the key properties of 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide?
1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide has a molecular weight of 372.51 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-[2-methyl-4-(4-methylpiperidine-1-carbonyl)phenyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 126793039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).