N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide

C21H30N4O4 — CID 166217851

IUPACN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide
SMILESCc1noc(C)c1N(C)C(=O)CC1(CC(=O)N(C)c2c(C)noc2C)CCCC1
InChIInChI=1S/C21H30N4O4/c1-13-19(15(3)28-22-13)24(5)17(26)11-21(9-7-8-10-21)12-18(27)25(6)20-14(2)23-29-16(20)4/h7-12H2,1-6H3
InChIKeyZENSFJUWFIQAAQ-UHFFFAOYSA-N
MW402.50 g/mol
LogP3.86
Rot. Bonds6

About N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide

N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide (PubChem CID 166217851) has the molecular formula C21H30N4O4 and a molecular weight of 402.50 g/mol. Its IUPAC name is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide
PubChem CID166217851
Molecular FormulaC21H30N4O4
Molecular Weight402.50 g/mol
Exact Mass402.23
IUPAC NameN-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide
SMILESCc1noc(C)c1N(C)C(=O)CC1(CC(=O)N(C)c2c(C)noc2C)CCCC1
InChIInChI=1S/C21H30N4O4/c1-13-19(15(3)28-22-13)24(5)17(26)11-21(9-7-8-10-21)12-18(27)25(6)20-14(2)23-29-16(20)4/h7-12H2,1-6H3
InChIKeyZENSFJUWFIQAAQ-UHFFFAOYSA-N
XLogP3.86
TPSA92.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide with MolForge

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Related Compounds

(3,5-dimethyl-1,2-oxazol-4-yl)-methylcarbamic acid
CID 149149378
2-[1-[2-(N-methylanilino)-2-oxoethyl]cyclopentyl]acetic acid
CID 61070370
1-(aminomethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylcyclohexane-1-carboxamide
CID 115437572
2-[1-[2-[(3,4-dimethyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]cyclohexyl]acetic acid
CID 65488707
N-(2,2-difluoroethyl)-N,3,5-trimethyl-1,2-oxazol-4-amine
CID 130677337
2-[1-[2-[methyl(2-methylpropyl)amino]-2-oxoethyl]cyclopentyl]acetic acid
CID 61071498
methyl 2-[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-methylamino]acetate
CID 43407679
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102634876
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 79236291
2-cyclopentyloxy-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylacetamide
CID 75461539
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N,N-dimethylpropanamide
CID 60645997
2-(1-aminocyclopentyl)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
CID 79236390

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide?
The IUPAC name of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide (CID 166217851) is N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide.
What is the SMILES notation for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide?
The canonical SMILES for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide is Cc1noc(C)c1N(C)C(=O)CC1(CC(=O)N(C)c2c(C)noc2C)CCCC1.
What is the InChIKey of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide?
The InChIKey is ZENSFJUWFIQAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O4/c1-13-19(15(3)28-22-13)24(5)17(26)11-21(9-7-8-10-21)12-18(27)25(6)20-14(2)23-29-16(20)4/h7-12H2,1-6H3.
What are the key properties of N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide?
N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide has a molecular weight of 402.50 g/mol, XLogP of 3.86, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)-methylamino]-2-oxoethyl]cyclopentyl]-N-methylacetamide is sourced from PubChem (CID 166217851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).