N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine

C14H21N — CID 115705716

IUPACN-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCCC(C)NC1CCc2cc(C)ccc21
InChIInChI=1S/C14H21N/c1-4-11(3)15-14-8-6-12-9-10(2)5-7-13(12)14/h5,7,9,11,14-15H,4,6,8H2,1-3H3
InChIKeyGYEFZANPHWBMEZ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.37
Rot. Bonds3

About N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine

N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 115705716) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID115705716
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCCC(C)NC1CCc2cc(C)ccc21
InChIInChI=1S/C14H21N/c1-4-11(3)15-14-8-6-12-9-10(2)5-7-13(12)14/h5,7,9,11,14-15H,4,6,8H2,1-3H3
InChIKeyGYEFZANPHWBMEZ-UHFFFAOYSA-N
XLogP3.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-[(5-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 103922391
N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43190307
2-N-(5-chloro-2,3-dihydro-1H-inden-1-yl)-1-N,1-N-diethylpropane-1,2-diamine
CID 81345581
1-N-heptan-2-yl-2,3-dihydro-1H-indene-1,5-diamine
CID 79725171
5-bromo-N-(2-methylpentan-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 63455836
6-methyl-N-(3-methylbutan-2-yl)-2,3-dihydro-1H-inden-1-amine
CID 81300726
1-N-(1-methoxypropan-2-yl)-2,3-dihydro-1H-indene-1,5-diamine
CID 79735935
3-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 81338301
1-N-(1-methylsulfonylpropan-2-yl)-2,3-dihydro-1H-indene-1,5-diamine
CID 79741972
5-fluoro-N-[1-(4-methylphenyl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 115710200
N-(4-ethylsulfanylbutan-2-yl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 115725424
5-chloro-N-pent-4-yn-2-yl-2,3-dihydro-1H-inden-1-amine
CID 115725341

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine (CID 115705716) is N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine is CCC(C)NC1CCc2cc(C)ccc21.
What is the InChIKey of N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GYEFZANPHWBMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-4-11(3)15-14-8-6-12-9-10(2)5-7-13(12)14/h5,7,9,11,14-15H,4,6,8H2,1-3H3.
What are the key properties of N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine?
N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 115705716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).