1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine

C24H23NO — CID 7047438

IUPAC1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1=C(c2ccccc2)Oc2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C24H23NO/c1-25(2)17-21-23(18-11-5-3-6-12-18)20-15-9-10-16-22(20)26-24(21)19-13-7-4-8-14-19/h3-16,23H,17H2,1-2H3/t23-/m0/s1
InChIKeySLTVLNJKFKLCRM-QHCPKHFHSA-N
MW341.45 g/mol
LogP5.18
Rot. Bonds4

About 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine

1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine (PubChem CID 7047438) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine
PubChem CID7047438
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC Name1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1=C(c2ccccc2)Oc2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C24H23NO/c1-25(2)17-21-23(18-11-5-3-6-12-18)20-15-9-10-16-22(20)26-24(21)19-13-7-4-8-14-19/h3-16,23H,17H2,1-2H3/t23-/m0/s1
InChIKeySLTVLNJKFKLCRM-QHCPKHFHSA-N
XLogP5.18
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.45
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(3,4-dimethoxyphenyl)-4-phenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine
CID 3456540
1-[(4R)-4-(4-fluorophenyl)-2-(2-methoxyphenyl)-4H-chromen-3-yl]-N,N-dimethylmethanamine
CID 1490769
[2-(4-methoxyphenyl)-4-phenyl-4H-chromen-3-yl]methyl-dimethylazanium chloride
CID 2869420
2-methylpropane;9-phenyl-9H-xanthene
CID 158880886
1-(2,4-diphenyl-4H-chromen-3-yl)-N-phenylmethanimine
CID 2853172
3-chloro-4-methylidene-2-(4-methylphenyl)-5-phenyl-5H-1-benzoxepine
CID 3815652
1-[(4R)-4-(4-methylphenyl)-2-phenyl-4H-chromen-3-yl]-N-phenylmethanimine
CID 40544814
2-[(5R)-3-chloro-2-(4-methylphenyl)-5-phenyl-5H-1-benzoxepin-4-ylidene]ethyl-dimethylazanium
CID 6996727
4-[[4-(2-methylphenyl)-2-phenyl-4H-chromen-3-yl]methyl]morpholin-4-ium
CID 3873909
ethane;3-phenyl-3H-1-benzofuran-2-one
CID 91570069
N-(2-bromophenyl)-1-[(4S)-4-(4-methylphenyl)-2-phenyl-4H-chromen-3-yl]methanimine
CID 27046835
2,3-bis(ethenyl)-4-phenyl-4H-chromene
CID 143647805

Frequently Asked Questions

What is the IUPAC name of 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine (CID 7047438) is 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine is CN(C)CC1=C(c2ccccc2)Oc2ccccc2[C@@H]1c1ccccc1.
What is the InChIKey of 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine?
The InChIKey is SLTVLNJKFKLCRM-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H23NO/c1-25(2)17-21-23(18-11-5-3-6-12-18)20-15-9-10-16-22(20)26-24(21)19-13-7-4-8-14-19/h3-16,23H,17H2,1-2H3/t23-/m0/s1.
What are the key properties of 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine?
1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine has a molecular weight of 341.45 g/mol, XLogP of 5.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4S)-2,4-diphenyl-4H-chromen-3-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 7047438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).