N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide

C16H24N2O — CID 63994419

IUPACN-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide
SMILESCCC(CC1CC1)NC(=O)c1ccc(NC)c(C)c1
InChIInChI=1S/C16H24N2O/c1-4-14(10-12-5-6-12)18-16(19)13-7-8-15(17-3)11(2)9-13/h7-9,12,14,17H,4-6,10H2,1-3H3,(H,18,19)
InChIKeyNKEVGUBHWFUUHX-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.35
Rot. Bonds6

About N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide

N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide (PubChem CID 63994419) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide
PubChem CID63994419
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide
SMILESCCC(CC1CC1)NC(=O)c1ccc(NC)c(C)c1
InChIInChI=1S/C16H24N2O/c1-4-14(10-12-5-6-12)18-16(19)13-7-8-15(17-3)11(2)9-13/h7-9,12,14,17H,4-6,10H2,1-3H3,(H,18,19)
InChIKeyNKEVGUBHWFUUHX-UHFFFAOYSA-N
XLogP3.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylbutan-2-yl)-5-methyl-2-(methylamino)benzamide
CID 63994027
N-(1-cyclopropylethyl)-3-methyl-4-(methylamino)benzamide
CID 63210093
N-(1-cyclopropylbutan-2-yl)-4-hydroxy-2-methylbenzamide
CID 103865517
4-(1-cyclopropylbutan-2-ylcarbamoyl)pyridine-2-carboxylic acid
CID 113385031
6-amino-N-(1-cyclopropylbutan-2-yl)pyridine-3-carboxamide
CID 63994023
4-amino-N-(1-cyclopropylbutan-2-yl)-3,5-difluorobenzamide
CID 63994420
N-(1-amino-3-methyl-1-oxobutan-2-yl)-3-methyl-4-(methylamino)benzamide
CID 106347135
4-(1-cyclopropylpropylamino)-N,3-dimethylbenzamide
CID 64917782
N-(1-cyclopropylbutan-2-yl)-5-iodothiophene-3-carboxamide
CID 78958436
3-methyl-4-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 114516650
N-(1-cyclopropylbutan-2-yl)-4-(4-hydroxybut-1-ynyl)benzamide
CID 63995979
4-(1-cyclopropylbutan-2-ylcarbamoylamino)-3-hydroxybenzoic acid
CID 63996353

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide?
The IUPAC name of N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide (CID 63994419) is N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide.
What is the SMILES notation for N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide?
The canonical SMILES for N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide is CCC(CC1CC1)NC(=O)c1ccc(NC)c(C)c1.
What is the InChIKey of N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide?
The InChIKey is NKEVGUBHWFUUHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-14(10-12-5-6-12)18-16(19)13-7-8-15(17-3)11(2)9-13/h7-9,12,14,17H,4-6,10H2,1-3H3,(H,18,19).
What are the key properties of N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide?
N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide has a molecular weight of 260.38 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylbutan-2-yl)-3-methyl-4-(methylamino)benzamide is sourced from PubChem (CID 63994419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).