(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine

C19H19N — CID 43149180

IUPAC(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine
SMILESCc1ccc(C(N)c2cccc3ccccc23)cc1C
InChIInChI=1S/C19H19N/c1-13-10-11-16(12-14(13)2)19(20)18-9-5-7-15-6-3-4-8-17(15)18/h3-12,19H,20H2,1-2H3
InChIKeyVBTLIIDVNNWYLF-UHFFFAOYSA-N
MW261.37 g/mol
LogP4.50
Rot. Bonds2

About (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine

(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine (PubChem CID 43149180) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine.

Molecular Properties

Compound Name(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine
PubChem CID43149180
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine
SMILESCc1ccc(C(N)c2cccc3ccccc23)cc1C
InChIInChI=1S/C19H19N/c1-13-10-11-16(12-14(13)2)19(20)18-9-5-7-15-6-3-4-8-17(15)18/h3-12,19H,20H2,1-2H3
InChIKeyVBTLIIDVNNWYLF-UHFFFAOYSA-N
XLogP4.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4-methoxy-3-methylphenyl)-naphthalen-1-ylmethanamine
CID 43379648
1-[bromo-(3,4-dimethylphenyl)methyl]naphthalene
CID 63435816
naphthalen-1-yl-(2,4,5-trimethylphenyl)methanamine
CID 64990309
(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanamine
CID 43149160
4-[amino(naphthalen-1-yl)methyl]aniline
CID 116936837
1,3-dihydro-2-benzofuran-5-yl(naphthalen-1-yl)methanamine
CID 63019163
(3-fluoro-4-methylphenyl)-isoquinolin-5-ylmethanamine
CID 62813992
(3-bromo-4-methylphenyl)-isoquinolin-8-ylmethanamine
CID 103135968
(3-chloro-4-methylphenyl)-isoquinolin-8-ylmethanamine
CID 103137069
(S)-(3-amino-4-methylphenyl)-naphthalen-1-ylmethanol
CID 100804217
(3,4-dimethylphenyl)-(2-fluoro-3-methoxyphenyl)methanamine
CID 105024853
(2-fluoro-3-methylphenyl)-naphthalen-2-ylmethanamine
CID 115850991

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine?
The IUPAC name of (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine (CID 43149180) is (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine.
What is the SMILES notation for (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine?
The canonical SMILES for (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine is Cc1ccc(C(N)c2cccc3ccccc23)cc1C.
What is the InChIKey of (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine?
The InChIKey is VBTLIIDVNNWYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-13-10-11-16(12-14(13)2)19(20)18-9-5-7-15-6-3-4-8-17(15)18/h3-12,19H,20H2,1-2H3.
What are the key properties of (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine?
(3,4-dimethylphenyl)-naphthalen-1-ylmethanamine has a molecular weight of 261.37 g/mol, XLogP of 4.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylphenyl)-naphthalen-1-ylmethanamine is sourced from PubChem (CID 43149180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).