N-benzyl-2,3-dihydro-1H-indol-5-amine

C15H16N2 — CID 22497856

IUPACN-benzyl-2,3-dihydro-1H-indol-5-amine
SMILESc1ccc(CNc2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C15H16N2/c1-2-4-12(5-3-1)11-17-14-6-7-15-13(10-14)8-9-16-15/h1-7,10,16-17H,8-9,11H2
InChIKeyBSHYAACTSRUFIA-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.27
Rot. Bonds3

About N-benzyl-2,3-dihydro-1H-indol-5-amine

N-benzyl-2,3-dihydro-1H-indol-5-amine (PubChem CID 22497856) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is N-benzyl-2,3-dihydro-1H-indol-5-amine.

Molecular Properties

Compound NameN-benzyl-2,3-dihydro-1H-indol-5-amine
PubChem CID22497856
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC NameN-benzyl-2,3-dihydro-1H-indol-5-amine
SMILESc1ccc(CNc2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C15H16N2/c1-2-4-12(5-3-1)11-17-14-6-7-15-13(10-14)8-9-16-15/h1-7,10,16-17H,8-9,11H2
InChIKeyBSHYAACTSRUFIA-UHFFFAOYSA-N
XLogP3.27
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-6,11-dihydro-5H-benzo[b][1]benzazepin-3-amine
CID 22664192
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)aniline
CID 61149619
N-(2,3-dihydro-1H-indol-5-yl)-2-phenylacetamide
CID 63252775
5-benzyl-2,3-dihydro-1H-indole
CID 19042869
N-methyl-2,3-dihydro-1H-indol-5-amine;dihydrochloride
CID 175177569
N-(2,3-dihydro-1H-indol-5-yl)-2-methyl-2-phenylpropanamide
CID 63253292
N-benzyl-3,4-difluoroaniline
CID 21321396
2-(benzylamino)-1-(2,3-dihydro-1H-indol-5-yl)butan-1-one
CID 82257869
N-[(4-chlorophenyl)methyl]-2,3-dihydro-1H-indol-5-amine;1-methylpyrazole-3-sulfonic acid
CID 87416470
N-(2,3-dihydro-1H-indol-5-yl)-2-phenylcyclopropane-1-carboxamide
CID 81485516
2,6-dichloro-N-(2,3-dihydro-1H-indol-5-yl)benzenesulfonamide
CID 43604311
N-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-7-amine
CID 90729657

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2,3-dihydro-1H-indol-5-amine?
The IUPAC name of N-benzyl-2,3-dihydro-1H-indol-5-amine (CID 22497856) is N-benzyl-2,3-dihydro-1H-indol-5-amine.
What is the SMILES notation for N-benzyl-2,3-dihydro-1H-indol-5-amine?
The canonical SMILES for N-benzyl-2,3-dihydro-1H-indol-5-amine is c1ccc(CNc2ccc3c(c2)CCN3)cc1.
What is the InChIKey of N-benzyl-2,3-dihydro-1H-indol-5-amine?
The InChIKey is BSHYAACTSRUFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c1-2-4-12(5-3-1)11-17-14-6-7-15-13(10-14)8-9-16-15/h1-7,10,16-17H,8-9,11H2.
What are the key properties of N-benzyl-2,3-dihydro-1H-indol-5-amine?
N-benzyl-2,3-dihydro-1H-indol-5-amine has a molecular weight of 224.31 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2,3-dihydro-1H-indol-5-amine is sourced from PubChem (CID 22497856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).