N-ethyl-3-(2-methylpentylamino)benzamide

C15H24N2O — CID 43680679

IUPACN-ethyl-3-(2-methylpentylamino)benzamide
SMILESCCCC(C)CNc1cccc(C(=O)NCC)c1
InChIInChI=1S/C15H24N2O/c1-4-7-12(3)11-17-14-9-6-8-13(10-14)15(18)16-5-2/h6,8-10,12,17H,4-5,7,11H2,1-3H3,(H,16,18)
InChIKeyNYOCDGPIMLIXCN-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.28
Rot. Bonds7

About N-ethyl-3-(2-methylpentylamino)benzamide

N-ethyl-3-(2-methylpentylamino)benzamide (PubChem CID 43680679) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-ethyl-3-(2-methylpentylamino)benzamide.

Molecular Properties

Compound NameN-ethyl-3-(2-methylpentylamino)benzamide
PubChem CID43680679
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-ethyl-3-(2-methylpentylamino)benzamide
SMILESCCCC(C)CNc1cccc(C(=O)NCC)c1
InChIInChI=1S/C15H24N2O/c1-4-7-12(3)11-17-14-9-6-8-13(10-14)15(18)16-5-2/h6,8-10,12,17H,4-5,7,11H2,1-3H3,(H,16,18)
InChIKeyNYOCDGPIMLIXCN-UHFFFAOYSA-N
XLogP3.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
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-ethyl-3-(2-methylpropylamino)benzamide
CID 43680721
3-[[(2R)-2-aminopentanoyl]amino]-N-ethylbenzamide
CID 103794052
3-methyl-N-(2-methylpentyl)aniline
CID 43103474
N-ethyl-3-(prop-2-ynylamino)benzamide
CID 60681699
N-ethyl-3-(2-methylpropylcarbamoylamino)benzamide
CID 47200674
3-(ethylamino)-N-propylbenzamide
CID 43676038
3-acetamido-N-ethylbenzamide
CID 17230670
3-iodo-N-(2-methylpentyl)aniline
CID 43124492
3-chloro-N-(2-methylpentyl)aniline
CID 43105827
4-(2-methylpentylamino)benzamide
CID 43201058
N-ethyl-3-(pyrimidin-5-ylmethylamino)benzamide
CID 62758960
3-[(5-bromothiophen-3-yl)methylamino]-N-ethylbenzamide
CID 43680774

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-methylpentylamino)benzamide?
The IUPAC name of N-ethyl-3-(2-methylpentylamino)benzamide (CID 43680679) is N-ethyl-3-(2-methylpentylamino)benzamide.
What is the SMILES notation for N-ethyl-3-(2-methylpentylamino)benzamide?
The canonical SMILES for N-ethyl-3-(2-methylpentylamino)benzamide is CCCC(C)CNc1cccc(C(=O)NCC)c1.
What is the InChIKey of N-ethyl-3-(2-methylpentylamino)benzamide?
The InChIKey is NYOCDGPIMLIXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-7-12(3)11-17-14-9-6-8-13(10-14)15(18)16-5-2/h6,8-10,12,17H,4-5,7,11H2,1-3H3,(H,16,18).
What are the key properties of N-ethyl-3-(2-methylpentylamino)benzamide?
N-ethyl-3-(2-methylpentylamino)benzamide has a molecular weight of 248.37 g/mol, XLogP of 3.28, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-methylpentylamino)benzamide is sourced from PubChem (CID 43680679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).