N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine

C18H15N3S — CID 8963026

IUPACN-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2c(-c3ccccc3)[nH]c3ccccc23)cs1
InChIInChI=1S/C18H15N3S/c1-19-18-21-15(11-22-18)16-13-9-5-6-10-14(13)20-17(16)12-7-3-2-4-8-12/h2-11,20H,1H3,(H,19,21)
InChIKeyMQUDKBNLFQSNDK-UHFFFAOYSA-N
MW305.41 g/mol
LogP5.00
Rot. Bonds3

About N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine

N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine (PubChem CID 8963026) has the molecular formula C18H15N3S and a molecular weight of 305.41 g/mol. Its IUPAC name is N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine
PubChem CID8963026
Molecular FormulaC18H15N3S
Molecular Weight305.41 g/mol
Exact Mass305.10
IUPAC NameN-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2c(-c3ccccc3)[nH]c3ccccc23)cs1
InChIInChI=1S/C18H15N3S/c1-19-18-21-15(11-22-18)16-13-9-5-6-10-14(13)20-17(16)12-7-3-2-4-8-12/h2-11,20H,1H3,(H,19,21)
InChIKeyMQUDKBNLFQSNDK-UHFFFAOYSA-N
XLogP5.00
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.41
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-(2-phenyl-1H-indol-3-yl)-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

4-(1H-benzimidazol-2-yl)-N-methyl-1,3-thiazol-2-amine
CID 14668556
3,3-dimethyl-N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]butanamide
CID 75401712
N-methyl-4-(4-methylnaphthalen-1-yl)-1,3-thiazol-2-amine
CID 83801577
N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
CID 24608215
3-(4-tert-butylphenyl)-2-phenyl-1H-indole
CID 12065981
4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-amine;hydrobromide
CID 166058003
N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-2-(trifluoromethyl)benzamide
CID 26177070
4-phenyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-quinolin-2-one
CID 10193998
N-[4-(2-methyl-1H-indol-3-yl)-1,3-thiazol-2-yl]-2-[(6-oxo-4-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetamide
CID 135987755
N-methyl-4-(2-propan-2-ylquinolin-4-yl)-1,3-thiazol-2-amine
CID 82447779
N-methyl-4-(3-methylazulen-1-yl)-1,3-thiazol-2-amine
CID 11436742
[2-[2-(methylamino)-1,3-thiazol-4-yl]phenyl]methanol
CID 88788468

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine (CID 8963026) is N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine is CNc1nc(-c2c(-c3ccccc3)[nH]c3ccccc23)cs1.
What is the InChIKey of N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine?
The InChIKey is MQUDKBNLFQSNDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3S/c1-19-18-21-15(11-22-18)16-13-9-5-6-10-14(13)20-17(16)12-7-3-2-4-8-12/h2-11,20H,1H3,(H,19,21).
What are the key properties of N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine?
N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine has a molecular weight of 305.41 g/mol, XLogP of 5.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-phenyl-1H-indol-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 8963026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).