N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine

C18H23N3 — CID 62280665

IUPACN-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cccnc1N1CCc2ccccc21
InChIInChI=1S/C18H23N3/c1-18(2,3)20-13-15-8-6-11-19-17(15)21-12-10-14-7-4-5-9-16(14)21/h4-9,11,20H,10,12-13H2,1-3H3
InChIKeyDNNVYOWIRUKELQ-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.66
Rot. Bonds3

About N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine

N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine (PubChem CID 62280665) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
PubChem CID62280665
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cccnc1N1CCc2ccccc21
InChIInChI=1S/C18H23N3/c1-18(2,3)20-13-15-8-6-11-19-17(15)21-12-10-14-7-4-5-9-16(14)21/h4-9,11,20H,10,12-13H2,1-3H3
InChIKeyDNNVYOWIRUKELQ-UHFFFAOYSA-N
XLogP3.66
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methyl-2-pyridinyl)-2,3-dihydroindole
CID 143449251
1-[2-(6-fluoro-2,3-dihydroindol-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 103502864
N-[[2-(6-fluoro-2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]ethanamine
CID 103502844
N-[[6-(2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62280837
N-[[2-(2,3-dihydroindol-1-yl)-3-fluoro-4-pyridinyl]methyl]propan-2-amine
CID 105388865
N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 62279125
2-(2,3-dihydroindol-1-yl)pyridine-3-carbothioamide
CID 24692134
N-[[2-(4-ethyl-3-methylpiperazin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 63620774
N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]methyl]pyrimidin-2-amine
CID 56745376
N-[[5-bromo-2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62280668
N-[[2-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62293989
1-[2-(2,3-dihydroindol-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 62281361

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine (CID 62280665) is N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cccnc1N1CCc2ccccc21.
What is the InChIKey of N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine?
The InChIKey is DNNVYOWIRUKELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-18(2,3)20-13-15-8-6-11-19-17(15)21-12-10-14-7-4-5-9-16(14)21/h4-9,11,20H,10,12-13H2,1-3H3.
What are the key properties of N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine?
N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62280665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).