N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide

C15H24N2O2 — CID 64549729

IUPACN-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide
SMILESCCC(C)(CO)NC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C15H24N2O2/c1-5-15(4,10-18)17-14(19)12-8-6-7-9-13(12)16-11(2)3/h6-9,11,16,18H,5,10H2,1-4H3,(H,17,19)
InChIKeyFFDPYGXPBRKPIE-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.40
Rot. Bonds6

About N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide

N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide (PubChem CID 64549729) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide
PubChem CID64549729
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide
SMILESCCC(C)(CO)NC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C15H24N2O2/c1-5-15(4,10-18)17-14(19)12-8-6-7-9-13(12)16-11(2)3/h6-9,11,16,18H,5,10H2,1-4H3,(H,17,19)
InChIKeyFFDPYGXPBRKPIE-UHFFFAOYSA-N
XLogP2.40
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(hydroxymethyl)pentan-3-yl]-2-(propan-2-ylamino)benzamide
CID 63108482
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-(propan-2-ylamino)benzamide
CID 106257692
N-ethyl-2-(propan-2-ylamino)benzamide
CID 63107552
methyl 2-methyl-2-[[2-(propan-2-ylamino)benzoyl]amino]propanoate
CID 63107970
N-(1-hydroxy-2-methylbutan-2-yl)-2-nitrobenzamide
CID 64557384
N-(1,3-dihydroxypropan-2-yl)-2-(propan-2-ylamino)benzamide
CID 65313573
2-(propan-2-ylamino)-N-propylbenzamide
CID 63107529
2-bromo-N-(1-hydroxy-2-methylbutan-2-yl)-3-methylbenzamide
CID 113372142
N-(2-methyl-2-methylsulfonylpropyl)-2-(propan-2-ylamino)benzamide
CID 79558263
N-(3-amino-2-hydroxy-3-oxopropyl)-2-(propan-2-ylamino)benzamide
CID 106177055
N-(4-hydroxy-2-methylbutyl)-2-(propan-2-ylamino)benzamide
CID 66109306
N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
CID 63107622

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide (CID 64549729) is N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide is CCC(C)(CO)NC(=O)c1ccccc1NC(C)C.
What is the InChIKey of N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide?
The InChIKey is FFDPYGXPBRKPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-15(4,10-18)17-14(19)12-8-6-7-9-13(12)16-11(2)3/h6-9,11,16,18H,5,10H2,1-4H3,(H,17,19).
What are the key properties of N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide?
N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide has a molecular weight of 264.37 g/mol, XLogP of 2.40, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylbutan-2-yl)-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 64549729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).