2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide

C14H17BrN2O2 — CID 47461034

IUPAC2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide
SMILESCC(=O)N(C)CC(=O)NC1(c2ccc(Br)cc2)CC1
InChIInChI=1S/C14H17BrN2O2/c1-10(18)17(2)9-13(19)16-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-9H2,1-2H3,(H,16,19)
InChIKeyCDQINFWJKNPIPR-UHFFFAOYSA-N
MW325.21 g/mol
LogP2.03
Rot. Bonds4

About 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide

2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide (PubChem CID 47461034) has the molecular formula C14H17BrN2O2 and a molecular weight of 325.21 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide
PubChem CID47461034
Molecular FormulaC14H17BrN2O2
Molecular Weight325.21 g/mol
Exact Mass324.05
IUPAC Name2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide
SMILESCC(=O)N(C)CC(=O)NC1(c2ccc(Br)cc2)CC1
InChIInChI=1S/C14H17BrN2O2/c1-10(18)17(2)9-13(19)16-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-9H2,1-2H3,(H,16,19)
InChIKeyCDQINFWJKNPIPR-UHFFFAOYSA-N
XLogP2.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.21
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide (CID 47461034) is 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide is CC(=O)N(C)CC(=O)NC1(c2ccc(Br)cc2)CC1.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide?
The InChIKey is CDQINFWJKNPIPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN2O2/c1-10(18)17(2)9-13(19)16-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-9H2,1-2H3,(H,16,19).
What are the key properties of 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide?
2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide has a molecular weight of 325.21 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-[1-(4-bromophenyl)cyclopropyl]acetamide is sourced from PubChem (CID 47461034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).