N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine

C17H23N3S — CID 8961705

IUPACN-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(NC3CCCC3)n2)c(C)n1C1CC1
InChIInChI=1S/C17H23N3S/c1-11-9-15(12(2)20(11)14-7-8-14)16-10-21-17(19-16)18-13-5-3-4-6-13/h9-10,13-14H,3-8H2,1-2H3,(H,18,19)
InChIKeyJUZWZXDKFXUBRB-UHFFFAOYSA-N
MW301.46 g/mol
LogP4.92
Rot. Bonds4

About N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine

N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine (PubChem CID 8961705) has the molecular formula C17H23N3S and a molecular weight of 301.46 g/mol. Its IUPAC name is N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine
PubChem CID8961705
Molecular FormulaC17H23N3S
Molecular Weight301.46 g/mol
Exact Mass301.16
IUPAC NameN-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(NC3CCCC3)n2)c(C)n1C1CC1
InChIInChI=1S/C17H23N3S/c1-11-9-15(12(2)20(11)14-7-8-14)16-10-21-17(19-16)18-13-5-3-4-6-13/h9-10,13-14H,3-8H2,1-2H3,(H,18,19)
InChIKeyJUZWZXDKFXUBRB-UHFFFAOYSA-N
XLogP4.92
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.46
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-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-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-N-[(4-fluorophenyl)methyl]-1,3-thiazol-2-amine
CID 24505635
4-[4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-yl]morpholine
CID 17443525
N-cyclopentyl-4-(2-methoxyphenyl)-1,3-thiazol-2-amine
CID 8961735
N-cyclopentyl-4-methyl-1,3-thiazol-2-amine;molecular hydrogen
CID 142956868
N-cyclohexyl-4-methyl-1,3-thiazol-2-amine;molecular hydrogen
CID 143290399
1-cyclopentyl-4,6-dimethyl-3-[2-(methylamino)-1,3-thiazol-4-yl]pyridin-2-one
CID 82525740
N-cyclopropyl-4-(2,5-dimethyl-1,3-thiazol-4-yl)-1,3-thiazol-2-amine
CID 63751719
3-[2,5-dimethyl-3-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)pyrrol-1-yl]thiolane 1,1-dioxide
CID 17486482
N-cyclopropyl-4-(3-methylphenyl)-1,3-thiazol-2-amine
CID 62941085
4-(1,3-benzodioxol-5-yl)-N-cyclopentyl-1,3-thiazol-2-amine
CID 8961741
4-(2-bromo-5-chlorophenyl)-N-cyclopropyl-1,3-thiazol-2-amine
CID 86657720
4-(4-bromo-2-fluorophenyl)-N-cyclopropyl-1,3-thiazol-2-amine
CID 82963453

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine (CID 8961705) is N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine is Cc1cc(-c2csc(NC3CCCC3)n2)c(C)n1C1CC1.
What is the InChIKey of N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine?
The InChIKey is JUZWZXDKFXUBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3S/c1-11-9-15(12(2)20(11)14-7-8-14)16-10-21-17(19-16)18-13-5-3-4-6-13/h9-10,13-14H,3-8H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine?
N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine has a molecular weight of 301.46 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 8961705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).