2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide

C18H20N2O — CID 43411225

IUPAC2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC2CCc3ccccc32)c1
InChIInChI=1S/C18H20N2O/c1-13-5-4-7-15(11-13)20-18(21)12-19-17-10-9-14-6-2-3-8-16(14)17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21)
InChIKeyPVPYCMPYPCNPCS-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.21
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide

2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide (PubChem CID 43411225) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide
PubChem CID43411225
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC2CCc3ccccc32)c1
InChIInChI=1S/C18H20N2O/c1-13-5-4-7-15(11-13)20-18(21)12-19-17-10-9-14-6-2-3-8-16(14)17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21)
InChIKeyPVPYCMPYPCNPCS-UHFFFAOYSA-N
XLogP3.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid
CID 13100819
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid;hydrochloride
CID 22976313
methyl-[2-(3-methylanilino)-2-oxoethyl]-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium
CID 9260580
dimethyl 5-[[2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)acetyl]amino]benzene-1,3-dicarboxylate
CID 3882933
N-butan-2-yl-2-(2,3-dihydro-1H-inden-1-ylamino)acetamide
CID 43424190
2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
CID 43215159
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60702700
N-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)acetamide
CID 43400828
2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide
CID 114546053
[2-(2,3-dihydro-1H-inden-1-ylamino)-2-oxoethyl] 2-(3-methylphenyl)acetate
CID 71822767
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
2-(1-cyclopropylethylamino)-N-(3-methylphenyl)acetamide
CID 43401776

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide (CID 43411225) is 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CNC2CCc3ccccc32)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide?
The InChIKey is PVPYCMPYPCNPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-13-5-4-7-15(11-13)20-18(21)12-19-17-10-9-14-6-2-3-8-16(14)17/h2-8,11,17,19H,9-10,12H2,1H3,(H,20,21).
What are the key properties of 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide?
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 43411225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).