2-(propan-2-ylamino)-N-propylbenzamide

C13H20N2O — CID 63107529

IUPAC2-(propan-2-ylamino)-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C13H20N2O/c1-4-9-14-13(16)11-7-5-6-8-12(11)15-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyUUEOQAZTFQNMGK-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.65
Rot. Bonds5

About 2-(propan-2-ylamino)-N-propylbenzamide

2-(propan-2-ylamino)-N-propylbenzamide (PubChem CID 63107529) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(propan-2-ylamino)-N-propylbenzamide.

Molecular Properties

Compound Name2-(propan-2-ylamino)-N-propylbenzamide
PubChem CID63107529
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(propan-2-ylamino)-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C13H20N2O/c1-4-9-14-13(16)11-7-5-6-8-12(11)15-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16)
InChIKeyUUEOQAZTFQNMGK-UHFFFAOYSA-N
XLogP2.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(propan-2-ylamino)benzamide
CID 63107552
N-(2-methylsulfanylethyl)-2-(propan-2-ylamino)benzamide
CID 63957461
N-(3-aminopropyl)-2-(propan-2-ylamino)benzamide
CID 63107952
N-[2-[ethyl(methyl)amino]ethyl]-2-(propan-2-ylamino)benzamide
CID 63108506
N-(4-amino-4-oxobutyl)-2-(propan-2-ylamino)benzamide
CID 63107810
methyl 3-[[2-(propan-2-ylamino)benzoyl]amino]propanoate
CID 63108007
2-hydrazinyl-N-propylbenzamide
CID 62238054
2-(2-methylpropanoylamino)-N-propylbenzamide
CID 31287518
N-[2-(ethylsulfamoyl)ethyl]-2-(propan-2-ylamino)benzamide
CID 106340243
2-[[(2S)-2-chloropropanoyl]amino]-N-propylbenzamide
CID 92660375
2-[[(2R)-2-chloropropanoyl]amino]-N-propylbenzamide
CID 92660374
2-(propan-2-ylamino)-N-prop-2-enylbenzamide
CID 63101364

Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-ylamino)-N-propylbenzamide?
The IUPAC name of 2-(propan-2-ylamino)-N-propylbenzamide (CID 63107529) is 2-(propan-2-ylamino)-N-propylbenzamide.
What is the SMILES notation for 2-(propan-2-ylamino)-N-propylbenzamide?
The canonical SMILES for 2-(propan-2-ylamino)-N-propylbenzamide is CCCNC(=O)c1ccccc1NC(C)C.
What is the InChIKey of 2-(propan-2-ylamino)-N-propylbenzamide?
The InChIKey is UUEOQAZTFQNMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-9-14-13(16)11-7-5-6-8-12(11)15-10(2)3/h5-8,10,15H,4,9H2,1-3H3,(H,14,16).
What are the key properties of 2-(propan-2-ylamino)-N-propylbenzamide?
2-(propan-2-ylamino)-N-propylbenzamide has a molecular weight of 220.32 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 2-(propan-2-ylamino)-N-propylbenzamide is sourced from PubChem (CID 63107529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).