N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide

C19H28N2O3 — CID 111459565

IUPACN-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide
SMILESCC(C)C(=O)N(C)Cc1ccc(C(=O)NCC2(O)CCCC2)cc1
InChIInChI=1S/C19H28N2O3/c1-14(2)18(23)21(3)12-15-6-8-16(9-7-15)17(22)20-13-19(24)10-4-5-11-19/h6-9,14,24H,4-5,10-13H2,1-3H3,(H,20,22)
InChIKeyFOZLSVGPJYEDSP-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.34
Rot. Bonds6

About N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide

N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide (PubChem CID 111459565) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide
PubChem CID111459565
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide
SMILESCC(C)C(=O)N(C)Cc1ccc(C(=O)NCC2(O)CCCC2)cc1
InChIInChI=1S/C19H28N2O3/c1-14(2)18(23)21(3)12-15-6-8-16(9-7-15)17(22)20-13-19(24)10-4-5-11-19/h6-9,14,24H,4-5,10-13H2,1-3H3,(H,20,22)
InChIKeyFOZLSVGPJYEDSP-UHFFFAOYSA-N
XLogP2.34
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide
CID 119566620
4-[2-[[4-[[methyl(2-methylpropanoyl)amino]methyl]benzoyl]amino]ethyl]benzoic acid
CID 120513002
4-hydroxy-N-[(1-hydroxycycloheptyl)methyl]benzamide
CID 65123054
N-[(1-hydroxycyclohexyl)methyl]-4-propan-2-ylsulfinylbenzamide
CID 111539894
4-ethyl-1-[[4-[[methyl(2-methylpropanoyl)amino]methyl]benzoyl]amino]cyclohexane-1-carboxylic acid
CID 120530168
4-bromo-N-[(1-hydroxycyclobutyl)methyl]benzamide
CID 111445424
N-[2-(furan-2-yl)-2-hydroxyethyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide
CID 111477186
4-[[2-bromopropanoyl(methyl)amino]methyl]-N-methylbenzamide
CID 114014417
4-formyl-N-[(1-hydroxycyclohexyl)methyl]benzamide
CID 111446164
4-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide
CID 64866990
4-[[(1-hydroxycyclopentanecarbonyl)-methylamino]methyl]-N-methylbenzamide
CID 110907310
N-[(1-hydroxycyclohexyl)methyl]pyridine-4-carboxamide
CID 64868056

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide (CID 111459565) is N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide is CC(C)C(=O)N(C)Cc1ccc(C(=O)NCC2(O)CCCC2)cc1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide?
The InChIKey is FOZLSVGPJYEDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-14(2)18(23)21(3)12-15-6-8-16(9-7-15)17(22)20-13-19(24)10-4-5-11-19/h6-9,14,24H,4-5,10-13H2,1-3H3,(H,20,22).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide?
N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide has a molecular weight of 332.44 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-4-[[methyl(2-methylpropanoyl)amino]methyl]benzamide is sourced from PubChem (CID 111459565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).