2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide

C21H26N2O4 — CID 60513356

IUPAC2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(Cc2ccccc2OC)C2CC2)c1
InChIInChI=1S/C21H26N2O4/c1-25-17-10-11-20(27-3)18(12-17)22-21(24)14-23(16-8-9-16)13-15-6-4-5-7-19(15)26-2/h4-7,10-12,16H,8-9,13-14H2,1-3H3,(H,22,24)
InChIKeyKDFPSEHMOROGHY-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.32
Rot. Bonds9

About 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide

2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide (PubChem CID 60513356) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
PubChem CID60513356
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC Name2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)CN(Cc2ccccc2OC)C2CC2)c1
InChIInChI=1S/C21H26N2O4/c1-25-17-10-11-20(27-3)18(12-17)22-21(24)14-23(16-8-9-16)13-15-6-4-5-7-19(15)26-2/h4-7,10-12,16H,8-9,13-14H2,1-3H3,(H,22,24)
InChIKeyKDFPSEHMOROGHY-UHFFFAOYSA-N
XLogP3.32
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
CID 8977636
2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide
CID 8769999
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(4-methylphenyl)acetamide
CID 34978448
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-propan-2-ylacetamide
CID 34979795
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-quinolin-5-ylacetamide
CID 34982278
3-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)propanamide
CID 113119822
N-(cyclohexylmethyl)-2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]acetamide
CID 55828921
2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-N-(4-methoxy-2-nitrophenyl)acetamide
CID 8977885
2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-N-(4-methoxyphenyl)acetamide
CID 8977684
2-[cyclopropyl-[(2,4-dimethoxyphenyl)methyl]amino]acetic acid
CID 39364524
4-[[2-[cyclopentyl-[(2-methoxyphenyl)methyl]amino]acetyl]amino]benzamide
CID 91838731
2-(N-acetyl-2-ethylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113169147

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide (CID 60513356) is 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide is COc1ccc(OC)c(NC(=O)CN(Cc2ccccc2OC)C2CC2)c1.
What is the InChIKey of 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is KDFPSEHMOROGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-25-17-10-11-20(27-3)18(12-17)22-21(24)14-23(16-8-9-16)13-15-6-4-5-7-19(15)26-2/h4-7,10-12,16H,8-9,13-14H2,1-3H3,(H,22,24).
What are the key properties of 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide?
2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 370.45 g/mol, XLogP of 3.32, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(2-methoxyphenyl)methyl]amino]-N-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 60513356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).