N-propan-2-ylnaphthalen-1-amine

C13H15N — CID 23088772

IUPACN-propan-2-ylnaphthalen-1-amine
SMILESCC(C)Nc1cccc2ccccc12
InChIInChI=1S/C13H15N/c1-10(2)14-13-9-5-7-11-6-3-4-8-12(11)13/h3-10,14H,1-2H3
InChIKeyOOYUXQFFKNSPSY-UHFFFAOYSA-N
MW185.27 g/mol
LogP3.66
Rot. Bonds2

About N-propan-2-ylnaphthalen-1-amine

N-propan-2-ylnaphthalen-1-amine (PubChem CID 23088772) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is N-propan-2-ylnaphthalen-1-amine.

Molecular Properties

Compound NameN-propan-2-ylnaphthalen-1-amine
PubChem CID23088772
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC NameN-propan-2-ylnaphthalen-1-amine
SMILESCC(C)Nc1cccc2ccccc12
InChIInChI=1S/C13H15N/c1-10(2)14-13-9-5-7-11-6-3-4-8-12(11)13/h3-10,14H,1-2H3
InChIKeyOOYUXQFFKNSPSY-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-propan-2-ylnaphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylnaphthalen-1-amine?
The IUPAC name of N-propan-2-ylnaphthalen-1-amine (CID 23088772) is N-propan-2-ylnaphthalen-1-amine.
What is the SMILES notation for N-propan-2-ylnaphthalen-1-amine?
The canonical SMILES for N-propan-2-ylnaphthalen-1-amine is CC(C)Nc1cccc2ccccc12.
What is the InChIKey of N-propan-2-ylnaphthalen-1-amine?
The InChIKey is OOYUXQFFKNSPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N/c1-10(2)14-13-9-5-7-11-6-3-4-8-12(11)13/h3-10,14H,1-2H3.
What are the key properties of N-propan-2-ylnaphthalen-1-amine?
N-propan-2-ylnaphthalen-1-amine has a molecular weight of 185.27 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylnaphthalen-1-amine is sourced from PubChem (CID 23088772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).