N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide

C17H25NO3 — CID 78860034

IUPACN-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)N(CC(C)C)C2CC2)c1
InChIInChI=1S/C17H25NO3/c1-12(2)11-18(14-5-6-14)17(19)10-13-9-15(20-3)7-8-16(13)21-4/h7-9,12,14H,5-6,10-11H2,1-4H3
InChIKeyUYFLDAHHWFJNLV-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.89
Rot. Bonds7

About N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide

N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide (PubChem CID 78860034) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide
PubChem CID78860034
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide
SMILESCOc1ccc(OC)c(CC(=O)N(CC(C)C)C2CC2)c1
InChIInChI=1S/C17H25NO3/c1-12(2)11-18(14-5-6-14)17(19)10-13-9-15(20-3)7-8-16(13)21-4/h7-9,12,14H,5-6,10-11H2,1-4H3
InChIKeyUYFLDAHHWFJNLV-UHFFFAOYSA-N
XLogP2.89
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]pentanamide
CID 120560197
N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(4-ethylcyclohexyl)acetamide
CID 78852926
(2R)-2-amino-N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]propanamide;hydrochloride
CID 119286967
N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2-ethoxyacetamide
CID 52574681
2-[cyclopropyl-[2-(2,4-dimethoxyphenyl)acetyl]amino]acetic acid
CID 60827055
2-(5-acetyl-2-methoxyphenyl)-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]acetamide
CID 39966518
4-amino-N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]butanamide;hydrochloride
CID 119286973
2-(2,5-dimethoxyphenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119552036
2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-propan-2-ylacetamide
CID 34979795
N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 33078129
2-[cyclopropyl(2-methylpropyl)amino]-1-(2,5-dimethoxyphenyl)ethanol
CID 60968943
2-[cyclopropyl-[2-(2-methoxy-5-methylphenyl)acetyl]amino]acetic acid
CID 60826379

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide (CID 78860034) is N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide is COc1ccc(OC)c(CC(=O)N(CC(C)C)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide?
The InChIKey is UYFLDAHHWFJNLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-12(2)11-18(14-5-6-14)17(19)10-13-9-15(20-3)7-8-16(13)21-4/h7-9,12,14H,5-6,10-11H2,1-4H3.
What are the key properties of N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide?
N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide has a molecular weight of 291.39 g/mol, XLogP of 2.89, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,5-dimethoxyphenyl)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 78860034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).