1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine

C16H18N2 — CID 105034568

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H18N2/c17-16(9-12-3-2-8-18-11-12)15-7-6-13-4-1-5-14(13)10-15/h2-3,6-8,10-11,16H,1,4-5,9,17H2
InChIKeyNNVYPNPTWZUDHP-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.81
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine

1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine (PubChem CID 105034568) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine
PubChem CID105034568
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine
SMILESNC(Cc1cccnc1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H18N2/c17-16(9-12-3-2-8-18-11-12)15-7-6-13-4-1-5-14(13)10-15/h2-3,6-8,10-11,16H,1,4-5,9,17H2
InChIKeyNNVYPNPTWZUDHP-UHFFFAOYSA-N
XLogP2.81
TPSA38.91 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 ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chloro-4-pyridinyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 112655443
1-(3-cyclobutylphenyl)-2-pyridin-3-ylethanamine
CID 114602876
2-(4-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43152415
2-(4-bromophenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43109357
1-(2,3-dihydro-1H-inden-5-yl)-2-thiophen-3-ylethanamine
CID 61078821
1-(4-methoxy-3-methylphenyl)-2-pyridin-3-ylethanamine
CID 104736678
2-(2,3-dihydro-1H-inden-5-yl)-1-(3,4-dimethylphenyl)ethanamine
CID 115864878
2-pyridin-3-yl-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 62791242
1-(3-bromo-4-methoxyphenyl)-2-pyridin-3-ylethanamine
CID 105034619
1-(cyclohexen-1-yl)-2-pyridin-3-ylethanamine
CID 106652772
2-(4-methoxyphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43198190
1-(2,3-dihydro-1H-inden-5-yl)-2-(2-methylphenyl)ethanamine
CID 43115557

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine (CID 105034568) is 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine is NC(Cc1cccnc1)c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine?
The InChIKey is NNVYPNPTWZUDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c17-16(9-12-3-2-8-18-11-12)15-7-6-13-4-1-5-14(13)10-15/h2-3,6-8,10-11,16H,1,4-5,9,17H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine?
1-(2,3-dihydro-1H-inden-5-yl)-2-pyridin-3-ylethanamine has a molecular weight of 238.33 g/mol, XLogP of 2.81, 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-5-yl)-2-pyridin-3-ylethanamine is sourced from PubChem (CID 105034568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).