N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine

C19H18N2O2 — CID 50855511

IUPACN-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine
SMILESCOc1ccc(/N=C/c2ccn(-c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C19H18N2O2/c1-22-18-7-3-16(4-8-18)20-13-15-11-12-21(14-15)17-5-9-19(23-2)10-6-17/h3-14H,1-2H3/b20-13+
InChIKeyDZXWKLGNYOHQGP-DEDYPNTBSA-N
MW306.37 g/mol
LogP4.25
Rot. Bonds5

About N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine

N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine (PubChem CID 50855511) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine
PubChem CID50855511
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine
SMILESCOc1ccc(/N=C/c2ccn(-c3ccc(OC)cc3)c2)cc1
InChIInChI=1S/C19H18N2O2/c1-22-18-7-3-16(4-8-18)20-13-15-11-12-21(14-15)17-5-9-19(23-2)10-6-17/h3-14H,1-2H3/b20-13+
InChIKeyDZXWKLGNYOHQGP-DEDYPNTBSA-N
XLogP4.25
TPSA35.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[[1-(4-methoxyphenyl)pyrrol-3-yl]methylideneamino]-N,N-dimethylaniline
CID 50855638
N-(4-butan-2-ylphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine
CID 50855445
N-(4-iodo-3-methylphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine
CID 50855266
1-[1-(4-methoxyphenyl)pyrrol-3-yl]-N-[4-(4-nitrophenyl)sulfanylphenyl]methanimine
CID 50855596
N-naphthalen-2-yl-1-(1-phenylpyrrol-3-yl)methanimine
CID 50855490
N-(4-bromophenyl)-1-(1-phenylpyrrol-3-yl)methanimine
CID 50855402
N-(4-morpholin-4-ylphenyl)-1-(1-phenylpyrrol-3-yl)methanimine
CID 50854805
2-[[1-(4-methoxyphenyl)pyrrol-3-yl]methylidene]indene-1,3-dione
CID 50855335
4-methoxy-N-[(Z)-(1-phenylpyrrol-3-yl)methylideneamino]benzamide
CID 50855117
N-[(E)-[1-(4-methoxyphenyl)pyrrol-3-yl]methylideneamino]thiophene-2-carboxamide
CID 50855304
N-(4-methoxyphenyl)-1-(5-methyl-1-phenylpyrrol-3-yl)methanimine
CID 50857580
3-hydroxy-N-[(Z)-[1-(4-methoxyphenyl)pyrrol-3-yl]methylideneamino]naphthalene-2-carboxamide
CID 50855396

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine?
The IUPAC name of N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine (CID 50855511) is N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine.
What is the SMILES notation for N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine?
The canonical SMILES for N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine is COc1ccc(/N=C/c2ccn(-c3ccc(OC)cc3)c2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine?
The InChIKey is DZXWKLGNYOHQGP-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-22-18-7-3-16(4-8-18)20-13-15-11-12-21(14-15)17-5-9-19(23-2)10-6-17/h3-14H,1-2H3/b20-13+.
What are the key properties of N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine?
N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine has a molecular weight of 306.37 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1-[1-(4-methoxyphenyl)pyrrol-3-yl]methanimine is sourced from PubChem (CID 50855511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).