2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide

C17H26N2O — CID 16577693

IUPAC2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(C)C1CCCCCC1
InChIInChI=1S/C17H26N2O/c1-14-9-7-8-12-16(14)18-17(20)13-19(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3,(H,18,20)
InChIKeyZWBYQTVGZZFKSW-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.59
Rot. Bonds4

About 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide

2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide (PubChem CID 16577693) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
PubChem CID16577693
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(C)C1CCCCCC1
InChIInChI=1S/C17H26N2O/c1-14-9-7-8-12-16(14)18-17(20)13-19(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3,(H,18,20)
InChIKeyZWBYQTVGZZFKSW-UHFFFAOYSA-N
XLogP3.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[methyl-[4-(methylamino)cyclohexyl]amino]-N-(2-methylphenyl)acetamide
CID 79117144
2-[cycloheptyl(methylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 113153099
methyl 2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]benzoate
CID 40706173
N-(2-cyanophenyl)-2-[cycloheptyl(methyl)amino]acetamide
CID 16577691
1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea
CID 5051501
2-[cycloheptyl(methyl)amino]-N-phenylacetamide
CID 16577724
N-(3-amino-2-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 43266827
2-[cyclohexyl(methyl)amino]-N-(2-phenoxyphenyl)acetamide
CID 46800677
methyl 3-[[2-[cyclohexyl(methyl)amino]acetyl]amino]-4-methylbenzoate
CID 51170598
2-[(4-chlorophenyl)sulfonyl-cyclohexylamino]-N-(2-methylphenyl)acetamide
CID 1002059
2-[cyclohexyl(methyl)amino]-N-[(2-methylphenyl)methyl]acetamide
CID 51224648
2-[cyclopentyl(methyl)amino]-N-[(2,3-dimethylphenyl)carbamoyl]acetamide
CID 51282081

Frequently Asked Questions

What is the IUPAC name of 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide (CID 16577693) is 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CN(C)C1CCCCCC1.
What is the InChIKey of 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide?
The InChIKey is ZWBYQTVGZZFKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-14-9-7-8-12-16(14)18-17(20)13-19(2)15-10-5-3-4-6-11-15/h7-9,12,15H,3-6,10-11,13H2,1-2H3,(H,18,20).
What are the key properties of 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide?
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 16577693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).