(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine

C22H20N2 — CID 14048524

IUPAC(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine
SMILESN[C@H](c1ccc2ccccc2c1)[C@@H](N)c1ccc2ccccc2c1
InChIInChI=1S/C22H20N2/c23-21(19-11-9-15-5-1-3-7-17(15)13-19)22(24)20-12-10-16-6-2-4-8-18(16)14-20/h1-14,21-22H,23-24H2/t21-,22+
InChIKeyFAHMSYSXFWQYOW-SZPZYZBQSA-N
MW312.42 g/mol
LogP4.69
Rot. Bonds3

About (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine

(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine (PubChem CID 14048524) has the molecular formula C22H20N2 and a molecular weight of 312.42 g/mol. Its IUPAC name is (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine.

Molecular Properties

Compound Name(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine
PubChem CID14048524
Molecular FormulaC22H20N2
Molecular Weight312.42 g/mol
Exact Mass312.16
IUPAC Name(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine
SMILESN[C@H](c1ccc2ccccc2c1)[C@@H](N)c1ccc2ccccc2c1
InChIInChI=1S/C22H20N2/c23-21(19-11-9-15-5-1-3-7-17(15)13-19)22(24)20-12-10-16-6-2-4-8-18(16)14-20/h1-14,21-22H,23-24H2/t21-,22+
InChIKeyFAHMSYSXFWQYOW-SZPZYZBQSA-N
XLogP4.69
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

amino(naphthalen-2-yl)methanethiol
CID 116939563
1-naphthalen-2-ylethanamine
CID 3857145
amino(naphthalen-2-yl)methanol
CID 57110079
2-methyl-1-naphthalen-2-ylbutan-1-amine
CID 63718165
3-naphthalen-2-ylbutan-2-amine
CID 66436107
2-methoxy-1-naphthalen-2-ylbutan-1-amine
CID 116715210
2-ethoxy-1-naphthalen-2-ylpropan-1-amine
CID 64541977
2-[bromo(fluoro)methyl]naphthalene
CID 118536685
ethane;2-propan-2-ylnaphthalene
CID 142226111
naphthalen-2-ylmethanediol
CID 22496827
(4-fluorophenyl)-naphthalen-2-ylmethanamine
CID 43184816
(1R,2R)-2-(4-bromophenyl)-1-naphthalen-2-ylbut-3-en-1-amine
CID 53241965

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine?
The IUPAC name of (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine (CID 14048524) is (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine.
What is the SMILES notation for (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine?
The canonical SMILES for (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine is N[C@H](c1ccc2ccccc2c1)[C@@H](N)c1ccc2ccccc2c1.
What is the InChIKey of (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine?
The InChIKey is FAHMSYSXFWQYOW-SZPZYZBQSA-N. The full InChI is InChI=1S/C22H20N2/c23-21(19-11-9-15-5-1-3-7-17(15)13-19)22(24)20-12-10-16-6-2-4-8-18(16)14-20/h1-14,21-22H,23-24H2/t21-,22+.
What are the key properties of (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine?
(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine has a molecular weight of 312.42 g/mol, XLogP of 4.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine is sourced from PubChem (CID 14048524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).