N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine

C14H19N — CID 134049939

IUPACN-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine
SMILESC=C(C)CN(C)C1CCc2ccccc21
InChIInChI=1S/C14H19N/c1-11(2)10-15(3)14-9-8-12-6-4-5-7-13(12)14/h4-7,14H,1,8-10H2,2-3H3
InChIKeyYJQZSEDZWWAATF-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.18
Rot. Bonds3

About N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine

N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 134049939) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID134049939
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine
SMILESC=C(C)CN(C)C1CCc2ccccc21
InChIInChI=1S/C14H19N/c1-11(2)10-15(3)14-9-8-12-6-4-5-7-13(12)14/h4-7,14H,1,8-10H2,2-3H3
InChIKeyYJQZSEDZWWAATF-UHFFFAOYSA-N
XLogP3.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[methyl-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetic acid
CID 118026509
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-ethylacetamide
CID 134043159
N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine
CID 62682207
lithium (1R)-N-methyl-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine
CID 10511981
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-(methylcarbamoyl)acetamide
CID 47147183
2-[[2,3-dihydro-1H-inden-1-yl(methyl)amino]methyl]phenol
CID 82976717
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 134052147
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-(4-methylphenyl)acetamide
CID 36674283
N-(tert-butylcarbamoyl)-2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]acetamide
CID 134043055
2-[2,3-dihydro-1H-inden-1-yl(methyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 134052196
N'-(2,3-dihydro-1H-inden-1-yl)-N',2,2-trimethylpropane-1,3-diamine
CID 79646356
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone
CID 36674560

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine (CID 134049939) is N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine is C=C(C)CN(C)C1CCc2ccccc21.
What is the InChIKey of N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is YJQZSEDZWWAATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-11(2)10-15(3)14-9-8-12-6-4-5-7-13(12)14/h4-7,14H,1,8-10H2,2-3H3.
What are the key properties of N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine?
N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 201.31 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylprop-2-enyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 134049939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).