N,3-diphenylchromen-2-imine

C21H15NO — CID 135029902

IUPACN,3-diphenylchromen-2-imine
SMILESc1ccc(/N=c2\oc3ccccc3cc2-c2ccccc2)cc1
InChIInChI=1S/C21H15NO/c1-3-9-16(10-4-1)19-15-17-11-7-8-14-20(17)23-21(19)22-18-12-5-2-6-13-18/h1-15H/b22-21-
InChIKeyCZZJPQKRFSZTHR-DQRAZIAOSA-N
MW297.36 g/mol
LogP5.33
Rot. Bonds2

About N,3-diphenylchromen-2-imine

N,3-diphenylchromen-2-imine (PubChem CID 135029902) has the molecular formula C21H15NO and a molecular weight of 297.36 g/mol. Its IUPAC name is N,3-diphenylchromen-2-imine.

Molecular Properties

Compound NameN,3-diphenylchromen-2-imine
PubChem CID135029902
Molecular FormulaC21H15NO
Molecular Weight297.36 g/mol
Exact Mass297.12
IUPAC NameN,3-diphenylchromen-2-imine
SMILESc1ccc(/N=c2\oc3ccccc3cc2-c2ccccc2)cc1
InChIInChI=1S/C21H15NO/c1-3-9-16(10-4-1)19-15-17-11-7-8-14-20(17)23-21(19)22-18-12-5-2-6-13-18/h1-15H/b22-21-
InChIKeyCZZJPQKRFSZTHR-DQRAZIAOSA-N
XLogP5.33
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.36
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis(3-phenylchromen-2-ylidene)benzene-1,4-dicarboxamide
CID 56956594
3-(benzenesulfonyl)-N-phenylchromen-2-imine
CID 6622390
3-phenylchromen-2-one;hydrochloride
CID 141206894
N-methyl-2-phenyliminochromene-3-carboxamide
CID 826595
4-[[3-(1H-benzimidazol-2-yl)chromen-2-ylidene]amino]benzonitrile
CID 4306404
1-(1-benzofuran-2-yl)-N-phenylmethanimine
CID 102313408
N-[(Z)-[3-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]chromen-2-ylidene]amino]aniline
CID 6064024
11-[4-(4-phenylphenyl)phenyl]-9-oxahexacyclo[11.8.0.02,10.03,8.04,20.016,21]henicosa-1,3,5,7,10,12,14,16(21),17,19-decaene
CID 164845553
2-[chloro-(2-phenylphenyl)methyl]-1-benzofuran
CID 70351350
(2Z)-2-hydroxyiminochromene-3-carboxylic acid
CID 97302642
1-(3-methylphenyl)-3-[(E)-[3-(4-methylphenyl)chromen-2-ylidene]amino]thiourea
CID 18884851
3-(4-methylphenyl)chromen-2-imine
CID 10657405

Frequently Asked Questions

What is the IUPAC name of N,3-diphenylchromen-2-imine?
The IUPAC name of N,3-diphenylchromen-2-imine (CID 135029902) is N,3-diphenylchromen-2-imine.
What is the SMILES notation for N,3-diphenylchromen-2-imine?
The canonical SMILES for N,3-diphenylchromen-2-imine is c1ccc(/N=c2\oc3ccccc3cc2-c2ccccc2)cc1.
What is the InChIKey of N,3-diphenylchromen-2-imine?
The InChIKey is CZZJPQKRFSZTHR-DQRAZIAOSA-N. The full InChI is InChI=1S/C21H15NO/c1-3-9-16(10-4-1)19-15-17-11-7-8-14-20(17)23-21(19)22-18-12-5-2-6-13-18/h1-15H/b22-21-.
What are the key properties of N,3-diphenylchromen-2-imine?
N,3-diphenylchromen-2-imine has a molecular weight of 297.36 g/mol, XLogP of 5.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diphenylchromen-2-imine is sourced from PubChem (CID 135029902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).