N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine

C22H19N — CID 143268577

IUPACN-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine
SMILESCN(C1=c2ccccc2=CCC=C1)c1cccc2ccccc12
InChIInChI=1S/C22H19N/c1-23(22-16-8-12-18-10-3-6-14-20(18)22)21-15-7-4-11-17-9-2-5-13-19(17)21/h2-3,5-16H,4H2,1H3
InChIKeyMDCUYRZUBQGCJW-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.82
Rot. Bonds2

About N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine

N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine (PubChem CID 143268577) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine.

Molecular Properties

Compound NameN-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine
PubChem CID143268577
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC NameN-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine
SMILESCN(C1=c2ccccc2=CCC=C1)c1cccc2ccccc12
InChIInChI=1S/C22H19N/c1-23(22-16-8-12-18-10-3-6-14-20(18)22)21-15-7-4-11-17-9-2-5-13-19(17)21/h2-3,5-16H,4H2,1H3
InChIKeyMDCUYRZUBQGCJW-UHFFFAOYSA-N
XLogP3.82
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Phenyl-1-naphthylamine
CID 7013
Mianserin
CID 4184
Proton sponge
CID 88675
N-1-Naphthylethylenediamine dihydrochloride
CID 15106
N-(1-Naphthyl)ethylenediamine
CID 15107
Depramine
CID 67534
Dibenzo(c,f)pyrazino(1,2-a)azepine, 1,2,3,4,10,14b-hexahydro-2-methyl-, (14bS)-
CID 154315
Aptiganel
CID 60840
1-(1-Naphthyl)piperazine
CID 1342
N,N-dimethyl-1-naphthylamine
CID 6848
N-Ethyl-1-naphthalenamine
CID 67043
1-(1-Naphthyl)piperazine hydrochloride
CID 2737391

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine?
The IUPAC name of N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine (CID 143268577) is N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine.
What is the SMILES notation for N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine?
The canonical SMILES for N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine is CN(C1=c2ccccc2=CCC=C1)c1cccc2ccccc12.
What is the InChIKey of N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine?
The InChIKey is MDCUYRZUBQGCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-23(22-16-8-12-18-10-3-6-14-20(18)22)21-15-7-4-11-17-9-2-5-13-19(17)21/h2-3,5-16H,4H2,1H3.
What are the key properties of N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine?
N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine has a molecular weight of 297.40 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-naphthalen-1-yl-8H-benzo[7]annulen-5-amine is sourced from PubChem (CID 143268577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).