N,N-dimethylfluoranthen-3-amine

C18H15N — CID 10514519

IUPACN,N-dimethylfluoranthen-3-amine
SMILESCN(C)c1ccc2c3c(cccc13)-c1ccccc1-2
InChIInChI=1S/C18H15N/c1-19(2)17-11-10-15-13-7-4-3-6-12(13)14-8-5-9-16(17)18(14)15/h3-11H,1-2H3
InChIKeyYJIGUJPBBIAGKZ-UHFFFAOYSA-N
MW245.32 g/mol
LogP4.55
Rot. Bonds1

About N,N-dimethylfluoranthen-3-amine

N,N-dimethylfluoranthen-3-amine (PubChem CID 10514519) has the molecular formula C18H15N and a molecular weight of 245.32 g/mol. Its IUPAC name is N,N-dimethylfluoranthen-3-amine.

Molecular Properties

Compound NameN,N-dimethylfluoranthen-3-amine
PubChem CID10514519
Molecular FormulaC18H15N
Molecular Weight245.32 g/mol
Exact Mass245.12
IUPAC NameN,N-dimethylfluoranthen-3-amine
SMILESCN(C)c1ccc2c3c(cccc13)-c1ccccc1-2
InChIInChI=1S/C18H15N/c1-19(2)17-11-10-15-13-7-4-3-6-12(13)14-8-5-9-16(17)18(14)15/h3-11H,1-2H3
InChIKeyYJIGUJPBBIAGKZ-UHFFFAOYSA-N
XLogP4.55
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylfluoranthen-3-amine?
The IUPAC name of N,N-dimethylfluoranthen-3-amine (CID 10514519) is N,N-dimethylfluoranthen-3-amine.
What is the SMILES notation for N,N-dimethylfluoranthen-3-amine?
The canonical SMILES for N,N-dimethylfluoranthen-3-amine is CN(C)c1ccc2c3c(cccc13)-c1ccccc1-2.
What is the InChIKey of N,N-dimethylfluoranthen-3-amine?
The InChIKey is YJIGUJPBBIAGKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N/c1-19(2)17-11-10-15-13-7-4-3-6-12(13)14-8-5-9-16(17)18(14)15/h3-11H,1-2H3.
What are the key properties of N,N-dimethylfluoranthen-3-amine?
N,N-dimethylfluoranthen-3-amine has a molecular weight of 245.32 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylfluoranthen-3-amine is sourced from PubChem (CID 10514519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).