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

C13H18N2O — CID 43215159

IUPAC2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCc2ccccc21
InChIInChI=1S/C13H18N2O/c1-15(2)13(16)9-14-12-8-7-10-5-3-4-6-11(10)12/h3-6,12,14H,7-9H2,1-2H3
InChIKeyLTWITJHMSLDFAT-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.35
Rot. Bonds3

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

2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide (PubChem CID 43215159) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
PubChem CID43215159
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCc2ccccc21
InChIInChI=1S/C13H18N2O/c1-15(2)13(16)9-14-12-8-7-10-5-3-4-6-11(10)12/h3-6,12,14H,7-9H2,1-2H3
InChIKeyLTWITJHMSLDFAT-UHFFFAOYSA-N
XLogP1.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
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
N-cyclopropyl-N-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)acetamide
CID 61487918
N-butan-2-yl-2-(2,3-dihydro-1H-inden-1-ylamino)acetamide
CID 43424190
3-(2,3-dihydro-1H-inden-1-ylamino)propanoic acid
CID 43088449
N-[2-(2,3-dihydro-1H-inden-1-ylamino)ethyl]acetamide
CID 43206104
2-(2,3-dihydro-1H-inden-1-ylamino)-1-piperidin-1-ylethanone
CID 43411240
3-(2,3-dihydro-1H-inden-1-ylamino)-2-methylpropanoic acid
CID 43652106
methyl 2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)acetate
CID 19794096
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60702700
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide
CID 43411225
3-(2,3-dihydro-1H-inden-1-ylamino)-2-methylpropanamide
CID 43652107

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide (CID 43215159) is 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide is CN(C)C(=O)CNC1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide?
The InChIKey is LTWITJHMSLDFAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-15(2)13(16)9-14-12-8-7-10-5-3-4-6-11(10)12/h3-6,12,14H,7-9H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide?
2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide has a molecular weight of 218.30 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 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,N-dimethylacetamide is sourced from PubChem (CID 43215159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).