N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide

C16H23N3O2 — CID 60851393

IUPACN-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide
SMILESCC(=O)Nc1cc(NC(=O)CNC2CCCC2)ccc1C
InChIInChI=1S/C16H23N3O2/c1-11-7-8-14(9-15(11)18-12(2)20)19-16(21)10-17-13-5-3-4-6-13/h7-9,13,17H,3-6,10H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMMEGRPWCIFUZMI-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.42
Rot. Bonds5

About N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide

N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide (PubChem CID 60851393) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide
PubChem CID60851393
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide
SMILESCC(=O)Nc1cc(NC(=O)CNC2CCCC2)ccc1C
InChIInChI=1S/C16H23N3O2/c1-11-7-8-14(9-15(11)18-12(2)20)19-16(21)10-17-13-5-3-4-6-13/h7-9,13,17H,3-6,10H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyMMEGRPWCIFUZMI-UHFFFAOYSA-N
XLogP2.42
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamido-3-chlorophenyl)-2-(cyclopentylamino)acetamide
CID 60720174
N-(3-bromo-4-methylphenyl)-2-(cyclohexylamino)acetamide
CID 108993617
2-(cycloheptylamino)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
CID 4790618
2-(cyclopentylamino)-N-(4-hydroxyphenyl)acetamide
CID 54918004
2-(cyclooctylamino)-N-(3,4-difluorophenyl)acetamide
CID 9265327
N-(5-acetamido-2-methylphenyl)cyclopentanecarboxamide
CID 46455101
2-(cyclopentylamino)-N-(2-methyl-1,3-benzothiazol-6-yl)acetamide
CID 60848317
N-(5-chloro-2-methylphenyl)-2-(cyclopropylamino)acetamide
CID 43405290
N-(3-acetamido-4-methylphenyl)-2-(azetidin-3-yl)acetamide
CID 64618777
2-chloro-5-[[2-(cyclopentylamino)acetyl]amino]benzoic acid
CID 60851750
N-(3-acetamido-4-methylphenyl)-2-(8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 119711365
N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide?
The IUPAC name of N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide (CID 60851393) is N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide.
What is the SMILES notation for N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide?
The canonical SMILES for N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide is CC(=O)Nc1cc(NC(=O)CNC2CCCC2)ccc1C.
What is the InChIKey of N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide?
The InChIKey is MMEGRPWCIFUZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11-7-8-14(9-15(11)18-12(2)20)19-16(21)10-17-13-5-3-4-6-13/h7-9,13,17H,3-6,10H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide?
N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide has a molecular weight of 289.38 g/mol, XLogP of 2.42, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methylphenyl)-2-(cyclopentylamino)acetamide is sourced from PubChem (CID 60851393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).