N-(2,2-dimethylpentyl)-4-(methylamino)benzamide

C15H24N2O — CID 115161129

IUPACN-(2,2-dimethylpentyl)-4-(methylamino)benzamide
SMILESCCCC(C)(C)CNC(=O)c1ccc(NC)cc1
InChIInChI=1S/C15H24N2O/c1-5-10-15(2,3)11-17-14(18)12-6-8-13(16-4)9-7-12/h6-9,16H,5,10-11H2,1-4H3,(H,17,18)
InChIKeyXZMPRRVHGYGCTN-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.28
Rot. Bonds6

About N-(2,2-dimethylpentyl)-4-(methylamino)benzamide

N-(2,2-dimethylpentyl)-4-(methylamino)benzamide (PubChem CID 115161129) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(2,2-dimethylpentyl)-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2,2-dimethylpentyl)-4-(methylamino)benzamide
PubChem CID115161129
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(2,2-dimethylpentyl)-4-(methylamino)benzamide
SMILESCCCC(C)(C)CNC(=O)c1ccc(NC)cc1
InChIInChI=1S/C15H24N2O/c1-5-10-15(2,3)11-17-14(18)12-6-8-13(16-4)9-7-12/h6-9,16H,5,10-11H2,1-4H3,(H,17,18)
InChIKeyXZMPRRVHGYGCTN-UHFFFAOYSA-N
XLogP3.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-amino-2,2-dimethylbutyl)-4-ethylbenzamide
CID 114148877
N-[2-(carbamoylamino)ethyl]-4-(methylamino)benzamide
CID 83114529
4-N-(4-hydroxy-2,2-dimethylbutyl)benzene-1,4-dicarboxamide
CID 103772906
N-[2,2-dimethyl-3-(methylamino)propyl]-4-ethylbenzamide
CID 115271137
N-(3-hydroxy-2,2-dimethylpropyl)-4-(propanoylamino)benzamide
CID 110178584
4-fluoro-N-(2-hydroxy-2-methylpentyl)benzamide
CID 113240357
N-(5-amino-2,2-dimethylpentyl)-4-(dimethylamino)benzamide
CID 106140589
N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide
CID 65042626
4-(methylamino)-N-[(4-methylphenyl)methyl]benzamide
CID 62167130
4-chloro-N-(2-hydroxy-2-methylpentyl)-3-methylbenzamide
CID 103760453
4-(aminomethyl)-N-(4-hydroxy-2,2-dimethylbutyl)benzamide
CID 106147923
4-bromo-N-(5-bromo-2,2-dimethylpentyl)benzamide
CID 114149699

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpentyl)-4-(methylamino)benzamide?
The IUPAC name of N-(2,2-dimethylpentyl)-4-(methylamino)benzamide (CID 115161129) is N-(2,2-dimethylpentyl)-4-(methylamino)benzamide.
What is the SMILES notation for N-(2,2-dimethylpentyl)-4-(methylamino)benzamide?
The canonical SMILES for N-(2,2-dimethylpentyl)-4-(methylamino)benzamide is CCCC(C)(C)CNC(=O)c1ccc(NC)cc1.
What is the InChIKey of N-(2,2-dimethylpentyl)-4-(methylamino)benzamide?
The InChIKey is XZMPRRVHGYGCTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-10-15(2,3)11-17-14(18)12-6-8-13(16-4)9-7-12/h6-9,16H,5,10-11H2,1-4H3,(H,17,18).
What are the key properties of N-(2,2-dimethylpentyl)-4-(methylamino)benzamide?
N-(2,2-dimethylpentyl)-4-(methylamino)benzamide has a molecular weight of 248.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpentyl)-4-(methylamino)benzamide is sourced from PubChem (CID 115161129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).