N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine

C11H11N3OS — CID 74253241

IUPACN-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
SMILESCOc1ccc(C=NNc2nccs2)cc1
InChIInChI=1S/C11H11N3OS/c1-15-10-4-2-9(3-5-10)8-13-14-11-12-6-7-16-11/h2-8H,1H3,(H,12,14)
InChIKeyOBCVRCXNAUJTCV-UHFFFAOYSA-N
MW233.30 g/mol
LogP2.60
Rot. Bonds4

About N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine

N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine (PubChem CID 74253241) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
PubChem CID74253241
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC NameN-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
SMILESCOc1ccc(C=NNc2nccs2)cc1
InChIInChI=1S/C11H11N3OS/c1-15-10-4-2-9(3-5-10)8-13-14-11-12-6-7-16-11/h2-8H,1H3,(H,12,14)
InChIKeyOBCVRCXNAUJTCV-UHFFFAOYSA-N
XLogP2.60
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 5349994
2-methoxy-4-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 2789383
2,6-dimethoxy-4-[(E)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 135781520
N-[(4-methoxyphenyl)methylideneamino]-4-thiophen-2-yl-1,3-thiazol-2-amine
CID 2332955
N-[(E)-(5-methylfuran-2-yl)methylideneamino]-1,3-thiazol-2-amine
CID 7245227
2,6-dibromo-4-[(E)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 135878036
2-chloro-4-[(Z)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 136822378
4-[(Z)-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]phenol
CID 135754061
4-(4-methoxyphenyl)-N-[(Z)-(4-propoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 110534560
N-[(Z)-(4-butoxyphenyl)methylideneamino]-4-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 110533621
4-(2-methoxyphenyl)-N-[(Z)-(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 8878425
N-(4-methoxyphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 45000900

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine?
The IUPAC name of N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine (CID 74253241) is N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine?
The canonical SMILES for N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine is COc1ccc(C=NNc2nccs2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine?
The InChIKey is OBCVRCXNAUJTCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-15-10-4-2-9(3-5-10)8-13-14-11-12-6-7-16-11/h2-8H,1H3,(H,12,14).
What are the key properties of N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine?
N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine has a molecular weight of 233.30 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine is sourced from PubChem (CID 74253241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).