N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide

C17H28N2O2 — CID 114944148

IUPACN-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCC(C)(C)OCC)c(C)c1
InChIInChI=1S/C17H28N2O2/c1-6-10-18-14-8-9-15(13(3)11-14)16(20)19-12-17(4,5)21-7-2/h8-9,11,18H,6-7,10,12H2,1-5H3,(H,19,20)
InChIKeyDDBKMCNZXRYLNG-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.36
Rot. Bonds8

About N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide

N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide (PubChem CID 114944148) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide.

Molecular Properties

Compound NameN-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide
PubChem CID114944148
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCC(C)(C)OCC)c(C)c1
InChIInChI=1S/C17H28N2O2/c1-6-10-18-14-8-9-15(13(3)11-14)16(20)19-12-17(4,5)21-7-2/h8-9,11,18H,6-7,10,12H2,1-5H3,(H,19,20)
InChIKeyDDBKMCNZXRYLNG-UHFFFAOYSA-N
XLogP3.36
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-hydroxypropylamino)-2-methyl-N-propylbenzamide
CID 142889038
N-(2-ethoxy-2-methylpropyl)-4-fluoro-2-hydroxybenzamide
CID 105343049
2,4-dibromo-N-(2-ethoxy-2-methylpropyl)benzamide
CID 105343041
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-(ethylamino)-2-methylbenzamide
CID 106280076
5-[(2-ethoxy-2-methylpropyl)carbamoyl]-2-methylbenzenesulfonyl chloride
CID 114944525
4-bromo-N-(2-ethoxy-2-methylpropyl)-2-(trifluoromethyl)benzamide
CID 105343037
4-(ethylamino)-2-methyl-N-pentylbenzamide
CID 113400130
N-(2-ethoxy-2-methylpropyl)-5-methyl-2-(methylamino)benzamide
CID 114944072
2-methyl-4-(propylamino)-N-pyrimidin-5-ylbenzamide
CID 107589959
2-methyl-N-[(2-methylcyclopentyl)methyl]-4-(propylamino)benzamide
CID 107420570
[2-methyl-4-(propylamino)phenyl]-phenylmethanone
CID 174896949
5-amino-N-(2-ethoxy-2-methylpropyl)-2,4-difluorobenzamide
CID 114940280

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide?
The IUPAC name of N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide (CID 114944148) is N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide.
What is the SMILES notation for N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide?
The canonical SMILES for N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide is CCCNc1ccc(C(=O)NCC(C)(C)OCC)c(C)c1.
What is the InChIKey of N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide?
The InChIKey is DDBKMCNZXRYLNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-6-10-18-14-8-9-15(13(3)11-14)16(20)19-12-17(4,5)21-7-2/h8-9,11,18H,6-7,10,12H2,1-5H3,(H,19,20).
What are the key properties of N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide?
N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide has a molecular weight of 292.42 g/mol, XLogP of 3.36, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-methylpropyl)-2-methyl-4-(propylamino)benzamide is sourced from PubChem (CID 114944148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).