cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium

C14H20N3O3+ — CID 7297720

IUPACcyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium
SMILESCOc1ccc(NC(=O)CNC(=O)C[NH2+]C2CC2)cc1
InChIInChI=1S/C14H19N3O3/c1-20-12-6-4-11(5-7-12)17-14(19)9-16-13(18)8-15-10-2-3-10/h4-7,10,15H,2-3,8-9H2,1H3,(H,16,18)(H,17,19)/p+1
InChIKeyDFFRQYILLRBXSN-UHFFFAOYSA-O
MW278.33 g/mol
LogP-0.52
Rot. Bonds7

About cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium

cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium (PubChem CID 7297720) has the molecular formula C14H20N3O3+ and a molecular weight of 278.33 g/mol. Its IUPAC name is cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium.

Molecular Properties

Compound Namecyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium
PubChem CID7297720
Molecular FormulaC14H20N3O3+
Molecular Weight278.33 g/mol
Exact Mass278.15
IUPAC Namecyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium
SMILESCOc1ccc(NC(=O)CNC(=O)C[NH2+]C2CC2)cc1
InChIInChI=1S/C14H19N3O3/c1-20-12-6-4-11(5-7-12)17-14(19)9-16-13(18)8-15-10-2-3-10/h4-7,10,15H,2-3,8-9H2,1H3,(H,16,18)(H,17,19)/p+1
InChIKeyDFFRQYILLRBXSN-UHFFFAOYSA-O
XLogP-0.52
TPSA84.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium with MolForge

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Related Compounds

[2-(4-methoxyanilino)-2-oxoethyl]carbamic acid
CID 67025275
N-[2-(4-methoxyanilino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 112998708
cyclooctyl-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]azanium
CID 9265502
N-[2-(4-methoxyanilino)-2-oxoethyl]-2,2-dimethylpropanamide
CID 771979
2-(4-hydroxyphenyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]acetamide
CID 122191191
2-cyclopropyl-N-(4-methoxyphenyl)acetamide
CID 3008382
N-cyclopropyl-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]cyclobutanecarboxamide
CID 42770719
N-[2-(4-methoxyanilino)-2-oxoethyl]nonanamide
CID 5172800
N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]ethyl]cyclopropanecarboxamide
CID 115571333
N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)cyclopropanecarboxamide
CID 4625550
2-chloro-N-cyclopropyl-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]propanamide
CID 5087238
2-(ethylamino)-N-(4-methoxyphenyl)acetamide
CID 2113294

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium?
The IUPAC name of cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium (CID 7297720) is cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium.
What is the SMILES notation for cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium?
The canonical SMILES for cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium is COc1ccc(NC(=O)CNC(=O)C[NH2+]C2CC2)cc1.
What is the InChIKey of cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium?
The InChIKey is DFFRQYILLRBXSN-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H19N3O3/c1-20-12-6-4-11(5-7-12)17-14(19)9-16-13(18)8-15-10-2-3-10/h4-7,10,15H,2-3,8-9H2,1H3,(H,16,18)(H,17,19)/p+1.
What are the key properties of cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium?
cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium has a molecular weight of 278.33 g/mol, XLogP of -0.52, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[2-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]azanium is sourced from PubChem (CID 7297720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).