1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine

C16H18N2 — CID 65410729

IUPAC1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)C1Cc2ccccc2C1
InChIInChI=1S/C16H18N2/c1-17-16(14-7-4-8-18-11-14)15-9-12-5-2-3-6-13(12)10-15/h2-8,11,15-17H,9-10H2,1H3
InChIKeyTVXVTOQJAYCUJS-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.76
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine

1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine (PubChem CID 65410729) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine
PubChem CID65410729
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine
SMILESCNC(c1cccnc1)C1Cc2ccccc2C1
InChIInChI=1S/C16H18N2/c1-17-16(14-7-4-8-18-11-14)15-9-12-5-2-3-6-13(12)10-15/h2-8,11,15-17H,9-10H2,1H3
InChIKeyTVXVTOQJAYCUJS-UHFFFAOYSA-N
XLogP2.76
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 65412087
1-cyclohexyl-N-methyl-1-pyridin-3-ylmethanamine
CID 60817955
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 65409933
1-(3-ethylcyclopentyl)-N-methyl-1-pyridin-3-ylmethanamine
CID 65410433
1-(2,3-dihydro-1H-inden-2-yl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 65410726
1-(2,3-dihydro-1H-inden-2-yl)-1-(2,3-dihydro-1H-inden-5-yl)-N-methylmethanamine
CID 106892701
1-(2,3-dihydro-1H-inden-2-yl)-1-(3-fluoro-5-methylphenyl)-N-methylmethanamine
CID 79703756
[cyclopropyl(pyridin-3-yl)methyl]hydrazine
CID 89323342
N-[cyclopropyl(pyridin-3-yl)methyl]ethanamine
CID 60923514
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773
N-[2,3-dihydro-1-benzothiophen-2-yl(pyridin-3-yl)methyl]ethanamine
CID 105098407
[2,3-dihydro-1-benzothiophen-2-yl(pyridin-3-yl)methyl]hydrazine
CID 105287045

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine (CID 65410729) is 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine is CNC(c1cccnc1)C1Cc2ccccc2C1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine?
The InChIKey is TVXVTOQJAYCUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-17-16(14-7-4-8-18-11-14)15-9-12-5-2-3-6-13(12)10-15/h2-8,11,15-17H,9-10H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine?
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine has a molecular weight of 238.33 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-pyridin-3-ylmethanamine is sourced from PubChem (CID 65410729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).