N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine

C16H19N — CID 70389017

IUPACN-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine
SMILESCC(C)NC1Cc2cccc3cccc(c23)C1
InChIInChI=1S/C16H19N/c1-11(2)17-15-9-13-7-3-5-12-6-4-8-14(10-15)16(12)13/h3-8,11,15,17H,9-10H2,1-2H3
InChIKeyDZFBJLGYUQWFRK-UHFFFAOYSA-N
MW225.34 g/mol
LogP3.31
Rot. Bonds2

About N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine

N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine (PubChem CID 70389017) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine
PubChem CID70389017
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC NameN-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine
SMILESCC(C)NC1Cc2cccc3cccc(c23)C1
InChIInChI=1S/C16H19N/c1-11(2)17-15-9-13-7-3-5-12-6-4-8-14(10-15)16(12)13/h3-8,11,15,17H,9-10H2,1-2H3
InChIKeyDZFBJLGYUQWFRK-UHFFFAOYSA-N
XLogP3.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine?
The IUPAC name of N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine (CID 70389017) is N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine.
What is the SMILES notation for N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine?
The canonical SMILES for N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine is CC(C)NC1Cc2cccc3cccc(c23)C1.
What is the InChIKey of N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine?
The InChIKey is DZFBJLGYUQWFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-11(2)17-15-9-13-7-3-5-12-6-4-8-14(10-15)16(12)13/h3-8,11,15,17H,9-10H2,1-2H3.
What are the key properties of N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine?
N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine has a molecular weight of 225.34 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2,3-dihydro-1H-phenalen-2-amine is sourced from PubChem (CID 70389017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).