N-methyl-4-(5-methylhexan-2-ylamino)benzamide

C15H24N2O — CID 43683632

IUPACN-methyl-4-(5-methylhexan-2-ylamino)benzamide
SMILESCNC(=O)c1ccc(NC(C)CCC(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)5-6-12(3)17-14-9-7-13(8-10-14)15(18)16-4/h7-12,17H,5-6H2,1-4H3,(H,16,18)
InChIKeyQGGIWESLCZNBBE-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.28
Rot. Bonds6

About N-methyl-4-(5-methylhexan-2-ylamino)benzamide

N-methyl-4-(5-methylhexan-2-ylamino)benzamide (PubChem CID 43683632) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-methyl-4-(5-methylhexan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-methyl-4-(5-methylhexan-2-ylamino)benzamide
PubChem CID43683632
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-methyl-4-(5-methylhexan-2-ylamino)benzamide
SMILESCNC(=O)c1ccc(NC(C)CCC(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-11(2)5-6-12(3)17-14-9-7-13(8-10-14)15(18)16-4/h7-12,17H,5-6H2,1-4H3,(H,16,18)
InChIKeyQGGIWESLCZNBBE-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

4-(hexan-2-ylamino)-N-methylbenzamide
CID 43781053
N-cyclopropyl-4-(5-methylhexan-2-ylamino)benzamide
CID 43687524
1-methyl-3-[4-(5-methylhexan-2-ylamino)phenyl]urea
CID 43744375
1-N,4-N-bis(5-methylhexan-2-yl)benzene-1,4-diamine
CID 159136598
N,N-dimethyl-4-(5-methylhexan-2-ylamino)benzamide
CID 43681981
4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide
CID 113489746
N-methyl-4-(5-methylhexan-2-ylamino)pyridine-2-carboxamide
CID 63925495
1-N,4-N-bis(5-methylhexan-2-yl)benzene-1,4-diamine;1-N,4-N-di(butan-2-yl)benzene-1,4-diamine
CID 19805826
N-methyl-4-(1-pyrrolidin-2-ylpropan-2-ylamino)benzamide
CID 79540902
N-methyl-4-(2-methylpropylcarbamoylamino)benzamide
CID 47200661
N-ethyl-4-(heptan-2-ylamino)benzamide
CID 43728460
4-[[[ethylamino-(5-methylhexan-2-ylamino)methylidene]amino]methyl]-N-methylbenzamide
CID 111203574

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(5-methylhexan-2-ylamino)benzamide?
The IUPAC name of N-methyl-4-(5-methylhexan-2-ylamino)benzamide (CID 43683632) is N-methyl-4-(5-methylhexan-2-ylamino)benzamide.
What is the SMILES notation for N-methyl-4-(5-methylhexan-2-ylamino)benzamide?
The canonical SMILES for N-methyl-4-(5-methylhexan-2-ylamino)benzamide is CNC(=O)c1ccc(NC(C)CCC(C)C)cc1.
What is the InChIKey of N-methyl-4-(5-methylhexan-2-ylamino)benzamide?
The InChIKey is QGGIWESLCZNBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)5-6-12(3)17-14-9-7-13(8-10-14)15(18)16-4/h7-12,17H,5-6H2,1-4H3,(H,16,18).
What are the key properties of N-methyl-4-(5-methylhexan-2-ylamino)benzamide?
N-methyl-4-(5-methylhexan-2-ylamino)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-methyl-4-(5-methylhexan-2-ylamino)benzamide is sourced from PubChem (CID 43683632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).