[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol

C24H21NO — CID 139972868

IUPAC[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol
SMILESOC(c1cccc2ccccc12)(c1cccc2ccccc12)[C@@H]1CCN1
InChIInChI=1S/C24H21NO/c26-24(23-15-16-25-23,21-13-5-9-17-7-1-3-11-19(17)21)22-14-6-10-18-8-2-4-12-20(18)22/h1-14,23,25-26H,15-16H2/t23-/m0/s1
InChIKeyQRRODKKYAWRPKR-QHCPKHFHSA-N
MW339.44 g/mol
LogP4.59
Rot. Bonds3

About [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol

[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol (PubChem CID 139972868) has the molecular formula C24H21NO and a molecular weight of 339.44 g/mol. Its IUPAC name is [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol.

Molecular Properties

Compound Name[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol
PubChem CID139972868
Molecular FormulaC24H21NO
Molecular Weight339.44 g/mol
Exact Mass339.16
IUPAC Name[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol
SMILESOC(c1cccc2ccccc12)(c1cccc2ccccc12)[C@@H]1CCN1
InChIInChI=1S/C24H21NO/c26-24(23-15-16-25-23,21-13-5-9-17-7-1-3-11-19(17)21)22-14-6-10-18-8-2-4-12-20(18)22/h1-14,23,25-26H,15-16H2/t23-/m0/s1
InChIKeyQRRODKKYAWRPKR-QHCPKHFHSA-N
XLogP4.59
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[difluoro(naphthalen-1-yl)methyl]pyrrolidine
CID 116839033
[(2S)-azetidin-2-yl]-dinaphthalen-2-ylmethanol
CID 139972860
[dinaphthalen-1-yl(pyrrolidin-2-yl)methoxy]-trimethylsilane
CID 69476600
1,1,4,4-tetranaphthalen-1-ylbutane-1,2,3,4-tetrol
CID 23002853
[(2S)-1-benzylpyrrolidin-2-yl]-dinaphthalen-1-ylmethanol
CID 53235722
dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
CID 2733810
2,3-dimethyl-3-naphthalen-1-ylbutan-2-ol
CID 140553457
alpha,alpha-Diphenyl-2-pyrrolidinemethanol borane
CID 19782534
3-hydroxy-3-naphthalen-1-ylbutanoic acid
CID 598604
1-(trichloromethyl)naphthalene
CID 12791328
1-(1,1-dinaphthalen-1-ylethyl)naphthalene
CID 91541516
dinaphthalen-1-yl(1H-pyrrol-2-yl)methanol
CID 141216963

Frequently Asked Questions

What is the IUPAC name of [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol?
The IUPAC name of [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol (CID 139972868) is [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol.
What is the SMILES notation for [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol?
The canonical SMILES for [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol is OC(c1cccc2ccccc12)(c1cccc2ccccc12)[C@@H]1CCN1.
What is the InChIKey of [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol?
The InChIKey is QRRODKKYAWRPKR-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H21NO/c26-24(23-15-16-25-23,21-13-5-9-17-7-1-3-11-19(17)21)22-14-6-10-18-8-2-4-12-20(18)22/h1-14,23,25-26H,15-16H2/t23-/m0/s1.
What are the key properties of [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol?
[(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol has a molecular weight of 339.44 g/mol, XLogP of 4.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-azetidin-2-yl]-dinaphthalen-1-ylmethanol is sourced from PubChem (CID 139972868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).