N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine

C32H27N — CID 2801810

IUPACN,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine
SMILESCN(C)C=C1C(c2ccccc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccccc1
InChIInChI=1S/C32H27N/c1-33(2)23-28-29(24-15-7-3-8-16-24)31(26-19-11-5-12-20-26)32(27-21-13-6-14-22-27)30(28)25-17-9-4-10-18-25/h3-23H,1-2H3
InChIKeyCSQFZLPXGVZDMH-UHFFFAOYSA-N
MW425.58 g/mol
LogP7.67
Rot. Bonds5

About N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine

N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine (PubChem CID 2801810) has the molecular formula C32H27N and a molecular weight of 425.58 g/mol. Its IUPAC name is N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine
PubChem CID2801810
Molecular FormulaC32H27N
Molecular Weight425.58 g/mol
Exact Mass425.21
IUPAC NameN,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine
SMILESCN(C)C=C1C(c2ccccc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccccc1
InChIInChI=1S/C32H27N/c1-33(2)23-28-29(24-15-7-3-8-16-24)31(26-19-11-5-12-20-26)32(27-21-13-6-14-22-27)30(28)25-17-9-4-10-18-25/h3-23H,1-2H3
InChIKeyCSQFZLPXGVZDMH-UHFFFAOYSA-N
XLogP7.67
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.58
LogP ≤ 57.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(5,5-Diphenyl-pent-4-enyl)-methyl-phenethyl-amine
CID 44310861
Trimethyl-[3-(1-methyl-2,3,4,5-tetraphenylsilol-1-yl)propyl]azanium iodide
CID 46225950
(3,3-Diphenyl-allyl)-dimethyl-amine
CID 24053
(2,2-Diphenyl-vinyl)-dimethyl-amine
CID 3850746
(Z)-3-(dimethylamino)-1,2-diphenylprop-2-ene-1-thione
CID 2825097
3-(Dimethylamino)-1,2-diphenylprop-2-ene-1-thione
CID 4301034
1-[(1E,3E)-5-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)penta-1,3-dienyl]piperidine
CID 5713156
(1E,3E)-N,N-dimethyl-5-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)penta-1,3-dien-1-amine
CID 5713158
1,4-diphenyl-N,N-bis(2-phenylethyl)butan-2-amine
CID 172460041
[3-(2,3-Dimethylcycloprop-2-en-1-ylidene)-2,4,5-triphenylcyclopenta-1,4-dien-1-yl]benzene
CID 134982443
(3-Pentylidene-2,4,5-triphenylcyclopenta-1,4-dien-1-yl)benzene
CID 101159189
(2,3,4-Triphenyl-5-propan-2-ylidenecyclopenta-1,3-dien-1-yl)benzene
CID 134948684

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine?
The IUPAC name of N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine (CID 2801810) is N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine?
The canonical SMILES for N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine is CN(C)C=C1C(c2ccccc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccccc1.
What is the InChIKey of N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine?
The InChIKey is CSQFZLPXGVZDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27N/c1-33(2)23-28-29(24-15-7-3-8-16-24)31(26-19-11-5-12-20-26)32(27-21-13-6-14-22-27)30(28)25-17-9-4-10-18-25/h3-23H,1-2H3.
What are the key properties of N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine?
N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine has a molecular weight of 425.58 g/mol, XLogP of 7.67, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-ylidene)methanamine is sourced from PubChem (CID 2801810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).