N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine

C12H16N2 — CID 76853849

IUPACN-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine
SMILESc1ccc2c(c1)NCC2NCC1CC1
InChIInChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(8-14-11)13-7-9-5-6-9/h1-4,9,12-14H,5-8H2
InChIKeyOQYKKOZUHTXGBB-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.15
Rot. Bonds3

About N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine

N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine (PubChem CID 76853849) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine
PubChem CID76853849
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC NameN-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine
SMILESc1ccc2c(c1)NCC2NCC1CC1
InChIInChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(8-14-11)13-7-9-5-6-9/h1-4,9,12-14H,5-8H2
InChIKeyOQYKKOZUHTXGBB-UHFFFAOYSA-N
XLogP2.15
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573936
N-(cyclopropylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 43190759
N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-2,3,4,5-tetrahydro-1H-1-benzazepin-5-amine
CID 166242704
8-azatricyclo[8.2.2.02,7]tetradeca-2,4,6-triene
CID 154876558
N-(cyclohexylmethyl)-2,3-dihydro-1H-indole-3-carboxamide
CID 80566002
N-(ethoxymethyl)-1,2,3,4-tetrahydroquinolin-4-amine
CID 143386559
benzyl N-(2,3-dihydro-1H-indol-3-yl)carbamate;hydrochloride
CID 139270731
N-[(4-methylcyclohexyl)methyl]-3,4-dihydro-2H-thiochromen-4-amine
CID 63462609
3-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-2,3-dihydro-1H-indole
CID 80565688
3-(cyclopentylmethylamino)-1,3-dihydroindol-2-one
CID 43370920
N-(2,3-dihydro-1H-indol-3-ylmethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
CID 80566563
N-(cyclopentylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 43370878

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine?
The IUPAC name of N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine (CID 76853849) is N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine?
The canonical SMILES for N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine is c1ccc2c(c1)NCC2NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine?
The InChIKey is OQYKKOZUHTXGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-2-4-11-10(3-1)12(8-14-11)13-7-9-5-6-9/h1-4,9,12-14H,5-8H2.
What are the key properties of N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine?
N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine has a molecular weight of 188.27 g/mol, XLogP of 2.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2,3-dihydro-1H-indol-3-amine is sourced from PubChem (CID 76853849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).