3-(9,10-dihydroanthracen-9-yl)propan-1-amine

C17H19N — CID 10354158

IUPAC3-(9,10-dihydroanthracen-9-yl)propan-1-amine
SMILESNCCCC1c2ccccc2Cc2ccccc21
InChIInChI=1S/C17H19N/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,10-12,18H2
InChIKeyAUTKMGMMFJXIDV-UHFFFAOYSA-N
MW237.35 g/mol
LogP3.46
Rot. Bonds3

About 3-(9,10-dihydroanthracen-9-yl)propan-1-amine

3-(9,10-dihydroanthracen-9-yl)propan-1-amine (PubChem CID 10354158) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 3-(9,10-dihydroanthracen-9-yl)propan-1-amine.

Molecular Properties

Compound Name3-(9,10-dihydroanthracen-9-yl)propan-1-amine
PubChem CID10354158
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name3-(9,10-dihydroanthracen-9-yl)propan-1-amine
SMILESNCCCC1c2ccccc2Cc2ccccc21
InChIInChI=1S/C17H19N/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,10-12,18H2
InChIKeyAUTKMGMMFJXIDV-UHFFFAOYSA-N
XLogP3.46
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(9,10-dihydroanthracen-9-yl)propan-1-amine?
The IUPAC name of 3-(9,10-dihydroanthracen-9-yl)propan-1-amine (CID 10354158) is 3-(9,10-dihydroanthracen-9-yl)propan-1-amine.
What is the SMILES notation for 3-(9,10-dihydroanthracen-9-yl)propan-1-amine?
The canonical SMILES for 3-(9,10-dihydroanthracen-9-yl)propan-1-amine is NCCCC1c2ccccc2Cc2ccccc21.
What is the InChIKey of 3-(9,10-dihydroanthracen-9-yl)propan-1-amine?
The InChIKey is AUTKMGMMFJXIDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-4,6-9,17H,5,10-12,18H2.
What are the key properties of 3-(9,10-dihydroanthracen-9-yl)propan-1-amine?
3-(9,10-dihydroanthracen-9-yl)propan-1-amine has a molecular weight of 237.35 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9,10-dihydroanthracen-9-yl)propan-1-amine is sourced from PubChem (CID 10354158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).