2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide

C15H20BrNO — CID 103773778

IUPAC2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
SMILESCc1ccc(Br)c(C(=O)NCC2(C(C)C)CC2)c1
InChIInChI=1S/C15H20BrNO/c1-10(2)15(6-7-15)9-17-14(18)12-8-11(3)4-5-13(12)16/h4-5,8,10H,6-7,9H2,1-3H3,(H,17,18)
InChIKeyMZPVVHGKFCUUTN-UHFFFAOYSA-N
MW310.24 g/mol
LogP3.92
Rot. Bonds4

About 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide

2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide (PubChem CID 103773778) has the molecular formula C15H20BrNO and a molecular weight of 310.24 g/mol. Its IUPAC name is 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide.

Molecular Properties

Compound Name2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
PubChem CID103773778
Molecular FormulaC15H20BrNO
Molecular Weight310.24 g/mol
Exact Mass309.07
IUPAC Name2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
SMILESCc1ccc(Br)c(C(=O)NCC2(C(C)C)CC2)c1
InChIInChI=1S/C15H20BrNO/c1-10(2)15(6-7-15)9-17-14(18)12-8-11(3)4-5-13(12)16/h4-5,8,10H,6-7,9H2,1-3H3,(H,17,18)
InChIKeyMZPVVHGKFCUUTN-UHFFFAOYSA-N
XLogP3.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.24
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide with MolForge

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

Launch Full Analysis

Related Compounds

2-bromo-5-methoxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 113252964
2-bromo-5-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]benzamide
CID 107299419
2-bromo-N-[(1-hydroxycycloheptyl)methyl]-5-methylbenzamide
CID 81003216
4-bromo-3-hydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 103873707
2-bromo-N-(2-chloropropyl)-5-methylbenzamide
CID 114296737
2-bromo-5-methyl-N-[2-(2-methylpropanoylamino)ethyl]benzamide
CID 80957927
4-bromo-N-[(1-propan-2-ylcyclopropyl)methyl]-3-sulfamoylbenzamide
CID 103743847
2-bromo-N-(3-bromobutyl)-5-methylbenzamide
CID 114312710
2-bromo-N-(2,2-difluoroethyl)-5-methylbenzamide
CID 81002658
2,4-dihydroxy-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide
CID 103742421
2-bromo-5-methyl-N-(1-methylcyclopentyl)benzamide
CID 80987670
4-[(2-bromo-5-methylbenzoyl)amino]-3-methylbutanoic acid
CID 81110667

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The IUPAC name of 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide (CID 103773778) is 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide.
What is the SMILES notation for 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The canonical SMILES for 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide is Cc1ccc(Br)c(C(=O)NCC2(C(C)C)CC2)c1.
What is the InChIKey of 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
The InChIKey is MZPVVHGKFCUUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrNO/c1-10(2)15(6-7-15)9-17-14(18)12-8-11(3)4-5-13(12)16/h4-5,8,10H,6-7,9H2,1-3H3,(H,17,18).
What are the key properties of 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide?
2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide has a molecular weight of 310.24 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-methyl-N-[(1-propan-2-ylcyclopropyl)methyl]benzamide is sourced from PubChem (CID 103773778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).