1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine

C15H19N3 — CID 82877822

IUPAC1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine
SMILESCn1ccc(CC(N)C2CCc3ccccc32)n1
InChIInChI=1S/C15H19N3/c1-18-9-8-12(17-18)10-15(16)14-7-6-11-4-2-3-5-13(11)14/h2-5,8-9,14-15H,6-7,10,16H2,1H3
InChIKeyHLRPEVHEIVCGOG-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.02
Rot. Bonds3

About 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine

1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine (PubChem CID 82877822) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine
PubChem CID82877822
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine
SMILESCn1ccc(CC(N)C2CCc3ccccc32)n1
InChIInChI=1S/C15H19N3/c1-18-9-8-12(17-18)10-15(16)14-7-6-11-4-2-3-5-13(11)14/h2-5,8-9,14-15H,6-7,10,16H2,1H3
InChIKeyHLRPEVHEIVCGOG-UHFFFAOYSA-N
XLogP2.02
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydro-1H-inden-1-yl)-N-ethyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82878113
N-ethyl-2-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 82868525
1-(2,3-dihydro-1H-inden-1-yl)-2-phenylethanamine
CID 65405904
1-cyclooctyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82876973
1-(2,3-dihydro-1H-inden-1-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103010749
N-[2,3-dihydro-1H-inden-1-yl-(1-methylpyrazol-3-yl)methyl]ethanamine
CID 103130973
2-cyclopropyl-1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 65403573
2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 66395638
1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 23332534
1-cyclopropyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 82876061
2-(1-methylpyrazol-3-yl)-1-(thiolan-3-yl)ethanamine
CID 105175095
2-cyclopentyl-1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 65405512

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine?
The IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine (CID 82877822) is 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine is Cn1ccc(CC(N)C2CCc3ccccc32)n1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine?
The InChIKey is HLRPEVHEIVCGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-18-9-8-12(17-18)10-15(16)14-7-6-11-4-2-3-5-13(11)14/h2-5,8-9,14-15H,6-7,10,16H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine?
1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine has a molecular weight of 241.34 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-1-yl)-2-(1-methylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 82877822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).