5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine

C11H19N3OS — CID 103383122

IUPAC5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine
SMILESCOc1c(N)nsc1NCCC1CCCC1
InChIInChI=1S/C11H19N3OS/c1-15-9-10(12)14-16-11(9)13-7-6-8-4-2-3-5-8/h8,13H,2-7H2,1H3,(H2,12,14)
InChIKeyGHWWXTLHIGDWRC-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.73
Rot. Bonds5

About 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine

5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine (PubChem CID 103383122) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine
PubChem CID103383122
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC Name5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine
SMILESCOc1c(N)nsc1NCCC1CCCC1
InChIInChI=1S/C11H19N3OS/c1-15-9-10(12)14-16-11(9)13-7-6-8-4-2-3-5-8/h8,13H,2-7H2,1H3,(H2,12,14)
InChIKeyGHWWXTLHIGDWRC-UHFFFAOYSA-N
XLogP2.73
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-amino-5-(2-cyclohexylethylamino)-1,2-thiazole-4-carboxylate
CID 103383128
4-methoxy-5-N-(oxan-4-ylmethyl)-1,2-thiazole-3,5-diamine
CID 103380641
3-amino-5-(2-cyclopentylethylamino)-N-propan-2-yl-1,2-thiazole-4-carboxamide
CID 103383123
5-N-(2-cyclobutylethyl)-4-cyclopropyl-1,2-thiazole-3,5-diamine
CID 103365365
5-N-(2,2-dimethylpropyl)-4-methoxy-1,2-thiazole-3,5-diamine
CID 103378404
3-amino-5-(2-cyclohexylethylamino)-N,N-dimethyl-1,2-thiazole-4-sulfonamide
CID 103364216
4-methoxy-5-N-[2-(2-methoxyethoxy)ethyl]-1,2-thiazole-3,5-diamine
CID 103379304
4-cyclopropyl-5-N-(2-cyclopropylethyl)-1,2-thiazole-3,5-diamine
CID 103359905
ethyl 3-amino-5-(3-cyclopentylpropylamino)-1,2-thiazole-4-carboxylate
CID 106015648
4-methoxy-5-N-(3-methylsulfanylbutyl)-1,2-thiazole-3,5-diamine
CID 103384397
5-N-(cyclohexylmethyl)-4-methyl-1,2-thiazole-3,5-diamine
CID 103363934
2-[2-[(3-amino-4-methoxy-1,2-thiazol-5-yl)amino]ethoxy]acetamide
CID 106242128

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine (CID 103383122) is 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine is COc1c(N)nsc1NCCC1CCCC1.
What is the InChIKey of 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine?
The InChIKey is GHWWXTLHIGDWRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3OS/c1-15-9-10(12)14-16-11(9)13-7-6-8-4-2-3-5-8/h8,13H,2-7H2,1H3,(H2,12,14).
What are the key properties of 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine?
5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine has a molecular weight of 241.36 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-cyclopentylethyl)-4-methoxy-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103383122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).