N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine

C16H18N2 — CID 80649878

IUPACN-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine
SMILESc1ccc(CNCc2cccc3c2NCC3)cc1
InChIInChI=1S/C16H18N2/c1-2-5-13(6-3-1)11-17-12-15-8-4-7-14-9-10-18-16(14)15/h1-8,17-18H,9-12H2
InChIKeyRLLXJUOVALGSNA-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.94
Rot. Bonds4

About N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine

N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine (PubChem CID 80649878) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine
PubChem CID80649878
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine
SMILESc1ccc(CNCc2cccc3c2NCC3)cc1
InChIInChI=1S/C16H18N2/c1-2-5-13(6-3-1)11-17-12-15-8-4-7-14-9-10-18-16(14)15/h1-8,17-18H,9-12H2
InChIKeyRLLXJUOVALGSNA-UHFFFAOYSA-N
XLogP2.94
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromophenyl)-N-(2,3-dihydro-1H-indol-7-ylmethyl)methanamine
CID 80649698
N-benzyl-2-(1,2,3,4-tetrahydroquinolin-8-yl)ethanamine
CID 125424059
[1-[(2,3-dihydro-1H-indol-7-ylmethylamino)methyl]cyclopropyl]methanol
CID 113313189
1-pyridin-3-yl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)methanamine
CID 80648841
1-(1,3-benzodioxol-4-yl)-N-(2,3-dihydro-1H-indol-7-ylmethyl)methanamine
CID 80648411
4-(2,3-dihydro-1H-indol-7-ylmethylamino)butan-1-ol
CID 106840914
1-(2,3-dihydro-1H-indol-7-yl)-N-[(5-methylthiophen-2-yl)methyl]methanamine
CID 80649049
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-(3-methyl-4-pyridinyl)methanamine
CID 114699338
4-(2,3-dihydro-1H-indol-7-ylmethylamino)butanoic acid
CID 80649501
1-(2,3-dihydro-1H-indol-7-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 80649847
N-(2,3-dihydro-1H-indol-7-ylmethyl)-N',N'-diethylethane-1,2-diamine
CID 80650079
N-(2,3-dihydro-1H-indol-7-ylmethyl)-3-methylsulfanylpropan-1-amine
CID 80650038

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine?
The IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine (CID 80649878) is N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine is c1ccc(CNCc2cccc3c2NCC3)cc1.
What is the InChIKey of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine?
The InChIKey is RLLXJUOVALGSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-2-5-13(6-3-1)11-17-12-15-8-4-7-14-9-10-18-16(14)15/h1-8,17-18H,9-12H2.
What are the key properties of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine?
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine has a molecular weight of 238.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine is sourced from PubChem (CID 80649878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).