N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide

C15H21N3O2 — CID 62168218

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCC(=O)NC1CC1
InChIInChI=1S/C15H21N3O2/c1-2-9-16-13-6-4-3-5-12(13)15(20)17-10-14(19)18-11-7-8-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19)
InChIKeyFIHRJBVMSRXSHC-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.52
Rot. Bonds7

About N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide

N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide (PubChem CID 62168218) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
PubChem CID62168218
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCC(=O)NC1CC1
InChIInChI=1S/C15H21N3O2/c1-2-9-16-13-6-4-3-5-12(13)15(20)17-10-14(19)18-11-7-8-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19)
InChIKeyFIHRJBVMSRXSHC-UHFFFAOYSA-N
XLogP1.52
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957
N-cyclooctyl-2-(propylamino)benzamide
CID 63500402
N-(2-chloroprop-2-enyl)-2-(propylamino)benzamide
CID 113464736
2-(ethylamino)-N-(4-methylcyclohexyl)benzamide
CID 62171591
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279
N-[(4-methylcyclohexyl)methyl]-2-(propylamino)benzamide
CID 63501540
N-(3,5-dimethylcyclohexyl)-2-(propylamino)benzamide
CID 64732342
N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide
CID 63297170
N-[3-oxo-3-(propylamino)propyl]-2-(propylamino)benzamide
CID 62178281
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-(2-phenylethyl)benzamide
CID 9329082
2-[[2-(cyclohexylamino)-2-oxoethyl]amino]-N-(2-methylpropyl)benzamide
CID 86911442
N-[2-(cyclopentylamino)-2-oxoethyl]-2-methylbenzamide
CID 18106161

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide (CID 62168218) is N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)NCC(=O)NC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide?
The InChIKey is FIHRJBVMSRXSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-2-9-16-13-6-4-3-5-12(13)15(20)17-10-14(19)18-11-7-8-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide has a molecular weight of 275.35 g/mol, XLogP of 1.52, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide is sourced from PubChem (CID 62168218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).