N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine

C32H23N — CID 139964651

IUPACN-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine
SMILESC(=N/C(c1cccc2ccccc12)c1cccc2ccccc12)\c1ccc2ccccc2c1
InChIInChI=1S/C32H23N/c1-2-12-27-21-23(19-20-24(27)9-1)22-33-32(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-22,32H/b33-22+
InChIKeyWDMXANCNNPNRCS-STKMKYKTSA-N
MW421.54 g/mol
LogP8.35
Rot. Bonds4

About N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine

N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine (PubChem CID 139964651) has the molecular formula C32H23N and a molecular weight of 421.54 g/mol. Its IUPAC name is N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine.

Molecular Properties

Compound NameN-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine
PubChem CID139964651
Molecular FormulaC32H23N
Molecular Weight421.54 g/mol
Exact Mass421.18
IUPAC NameN-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine
SMILESC(=N/C(c1cccc2ccccc12)c1cccc2ccccc12)\c1ccc2ccccc2c1
InChIInChI=1S/C32H23N/c1-2-12-27-21-23(19-20-24(27)9-1)22-33-32(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-22,32H/b33-22+
InChIKeyWDMXANCNNPNRCS-STKMKYKTSA-N
XLogP8.35
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.54
LogP ≤ 58.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-naphthalen-2-yl-N-[(1S)-1-naphthalen-1-ylethyl]methanimine
CID 139062261
N-[bis(4-methylphenyl)methyl]-1-naphthalen-2-ylmethanimine
CID 139964746
N-[(1S)-1-naphthalen-1-ylethyl]-1-phenylmethanimine
CID 139081062
N-[(1R)-1-naphthalen-1-ylethyl]-1-(4-nitrophenyl)methanimine
CID 14974267
(E)-N-ethoxy-1-naphthalen-2-ylmethanimine
CID 89064505
anthracene;naphthalene;phenanthrene
CID 158591187
1-naphthalen-2-yl-N-prop-1-enylmethanimine
CID 71411928
(1S,2S)-1,2-dinaphthalen-1-ylethane-1,2-diol
CID 10470897
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
[3-(naphthalen-2-ylmethylideneamino)phenyl]methanol
CID 786243
(2R)-N-[(Z)-naphthalen-2-ylmethylideneamino]-2-naphthalen-1-yloxypropanamide
CID 7039270
ethane;methane;1-propan-2-ylnaphthalene
CID 160778548

Frequently Asked Questions

What is the IUPAC name of N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine?
The IUPAC name of N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine (CID 139964651) is N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine.
What is the SMILES notation for N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine?
The canonical SMILES for N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine is C(=N/C(c1cccc2ccccc12)c1cccc2ccccc12)\c1ccc2ccccc2c1.
What is the InChIKey of N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine?
The InChIKey is WDMXANCNNPNRCS-STKMKYKTSA-N. The full InChI is InChI=1S/C32H23N/c1-2-12-27-21-23(19-20-24(27)9-1)22-33-32(30-17-7-13-25-10-3-5-15-28(25)30)31-18-8-14-26-11-4-6-16-29(26)31/h1-22,32H/b33-22+.
What are the key properties of N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine?
N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine has a molecular weight of 421.54 g/mol, XLogP of 8.35, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dinaphthalen-1-ylmethyl)-1-naphthalen-2-ylmethanimine is sourced from PubChem (CID 139964651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).