4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene

C19H25NO — CID 174445102

IUPAC4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene
SMILESCN(C)c1ccc(C=O)cc1.Cc1cc(C)c(C)c(C)c1
InChIInChI=1S/C10H14.C9H11NO/c1-7-5-8(2)10(4)9(3)6-7;1-10(2)9-5-3-8(7-11)4-6-9/h5-6H,1-4H3;3-7H,1-2H3
InChIKeyPSPSIRRRVMYUKH-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.49
Rot. Bonds2

About 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene

4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene (PubChem CID 174445102) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene.

Molecular Properties

Compound Name4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene
PubChem CID174445102
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene
SMILESCN(C)c1ccc(C=O)cc1.Cc1cc(C)c(C)c(C)c1
InChIInChI=1S/C10H14.C9H11NO/c1-7-5-8(2)10(4)9(3)6-7;1-10(2)9-5-3-8(7-11)4-6-9/h5-6H,1-4H3;3-7H,1-2H3
InChIKeyPSPSIRRRVMYUKH-UHFFFAOYSA-N
XLogP4.49
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(dimethylamino)benzaldehyde;4-phenylbenzaldehyde
CID 19981020
2,5-diformylbenzene-1,4-dicarbonitrile;bis(4-(dimethylamino)benzaldehyde);2,5-dimethylbenzene-1,4-dicarbonitrile
CID 158391600
4-[2,2-bis[4-(dimethylamino)phenyl]-1-phenylethenyl]benzaldehyde
CID 102222128
3-[4-(dimethylamino)phenyl]-4-fluorobenzaldehyde
CID 39232113
4-[(Z)-2-[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]ethenyl]-N,N-dimethylaniline
CID 92530704
4-[[4-(dimethylamino)phenyl]methylideneamino]-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 3541583
ethane;N,N,4-trimethylaniline;1,2,3-trimethylbenzene
CID 142152742
4-(dimethylamino)benzaldehyde;(4-nitrophenyl)hydrazine
CID 87898824
N-[4-(dimethylamino)phenyl]-2-(2,3,5-trimethylphenoxy)acetamide
CID 887503
4-(N-ethyl-4-methylanilino)-3-methylbenzaldehyde
CID 63536813
sodium;hydride;4-methylbenzaldehyde
CID 173013137
N-[4-(dimethylamino)phenyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 112978164

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene?
The IUPAC name of 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene (CID 174445102) is 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene.
What is the SMILES notation for 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene?
The canonical SMILES for 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene is CN(C)c1ccc(C=O)cc1.Cc1cc(C)c(C)c(C)c1.
What is the InChIKey of 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene?
The InChIKey is PSPSIRRRVMYUKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14.C9H11NO/c1-7-5-8(2)10(4)9(3)6-7;1-10(2)9-5-3-8(7-11)4-6-9/h5-6H,1-4H3;3-7H,1-2H3.
What are the key properties of 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene?
4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene has a molecular weight of 283.41 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)benzaldehyde;1,2,3,5-tetramethylbenzene is sourced from PubChem (CID 174445102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).