2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine

C19H23N — CID 82821630

IUPAC2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine
SMILESCc1cccc(CNC2c3ccccc3CC2(C)C)c1
InChIInChI=1S/C19H23N/c1-14-7-6-8-15(11-14)13-20-18-17-10-5-4-9-16(17)12-19(18,2)3/h4-11,18,20H,12-13H2,1-3H3
InChIKeyVCWPVDZAYGOCAF-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.41
Rot. Bonds3

About 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine

2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine (PubChem CID 82821630) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine
PubChem CID82821630
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine
SMILESCc1cccc(CNC2c3ccccc3CC2(C)C)c1
InChIInChI=1S/C19H23N/c1-14-7-6-8-15(11-14)13-20-18-17-10-5-4-9-16(17)12-19(18,2)3/h4-11,18,20H,12-13H2,1-3H3
InChIKeyVCWPVDZAYGOCAF-UHFFFAOYSA-N
XLogP4.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dimethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,3-dihydroinden-1-amine
CID 82821354
2,2-dimethyl-N-(2-phenylethyl)-1,3-dihydroinden-1-amine
CID 82820863
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 115989408
N-[(2-methoxy-3-pyridinyl)methyl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 82797013
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
2,2-dimethyl-N-(3,3,3-trifluoropropyl)-1,3-dihydroinden-1-amine
CID 82814406
2,2-dimethyl-N-[(2-methylcyclopentyl)methyl]-1,3-dihydroinden-1-amine
CID 107417554
4-methyl-N-[(3-methylphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418179
2,2-dimethyl-3-[(3-methylphenyl)methylamino]cyclobutan-1-ol
CID 112633293
3-[(3-methylphenyl)methylamino]-1,3-dihydroindol-2-one
CID 43181980
N-ethoxy-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 82814561
N-(2,2-dimethyl-1,3-dihydroinden-1-yl)-5-methylpyridin-3-amine
CID 107584918

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine?
The IUPAC name of 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine (CID 82821630) is 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine is Cc1cccc(CNC2c3ccccc3CC2(C)C)c1.
What is the InChIKey of 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine?
The InChIKey is VCWPVDZAYGOCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-14-7-6-8-15(11-14)13-20-18-17-10-5-4-9-16(17)12-19(18,2)3/h4-11,18,20H,12-13H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine?
2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(3-methylphenyl)methyl]-1,3-dihydroinden-1-amine is sourced from PubChem (CID 82821630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).