4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide

C14H20N2O — CID 113489746

IUPAC4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(C)CC2CC2)cc1
InChIInChI=1S/C14H20N2O/c1-10(9-11-3-4-11)16-13-7-5-12(6-8-13)14(17)15-2/h5-8,10-11,16H,3-4,9H2,1-2H3,(H,15,17)
InChIKeyKUXPDKBDBRQGLT-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.65
Rot. Bonds5

About 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide

4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide (PubChem CID 113489746) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide.

Molecular Properties

Compound Name4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide
PubChem CID113489746
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(C)CC2CC2)cc1
InChIInChI=1S/C14H20N2O/c1-10(9-11-3-4-11)16-13-7-5-12(6-8-13)14(17)15-2/h5-8,10-11,16H,3-4,9H2,1-2H3,(H,15,17)
InChIKeyKUXPDKBDBRQGLT-UHFFFAOYSA-N
XLogP2.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-4-(1-pyrrolidin-2-ylpropan-2-ylamino)benzamide
CID 79540902
N-methyl-4-(5-methylhexan-2-ylamino)benzamide
CID 43683632
4-(1-cyclohexylethylamino)-N-methylbenzamide
CID 43781056
4-(1-amino-2-cyclopropylethyl)-N-methylbenzamide
CID 177148394
4-(hexan-2-ylamino)-N-methylbenzamide
CID 43781053
N-(1-cyclopropylpropan-2-yl)-4-propan-2-yloxyaniline
CID 115917457
2-[4-(1-cyclobutylpropan-2-ylamino)phenyl]-N-ethylacetamide
CID 115917694
4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
CID 47422905
4-[[2-(cyclopropylmethylamino)acetyl]amino]-N-methylbenzamide
CID 60868348
N-[3-(1-cyclopropylpropan-2-ylamino)phenyl]acetamide
CID 115916889
N-cyclopropyl-4-(5-methylhexan-2-ylamino)benzamide
CID 43687524
N-(1-cyclopropylpropan-2-yl)-4-(3-hydroxyprop-1-ynyl)benzamide
CID 63994001

Frequently Asked Questions

What is the IUPAC name of 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide?
The IUPAC name of 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide (CID 113489746) is 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide.
What is the SMILES notation for 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide?
The canonical SMILES for 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide is CNC(=O)c1ccc(NC(C)CC2CC2)cc1.
What is the InChIKey of 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide?
The InChIKey is KUXPDKBDBRQGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(9-11-3-4-11)16-13-7-5-12(6-8-13)14(17)15-2/h5-8,10-11,16H,3-4,9H2,1-2H3,(H,15,17).
What are the key properties of 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide?
4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide has a molecular weight of 232.33 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide is sourced from PubChem (CID 113489746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).