5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine

C11H21N3S — CID 103360689

IUPAC5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine
SMILESCC(C)CN(CC(C)C)c1cc(N)ns1
InChIInChI=1S/C11H21N3S/c1-8(2)6-14(7-9(3)4)11-5-10(12)13-15-11/h5,8-9H,6-7H2,1-4H3,(H2,12,13)
InChIKeyPKBOIHZTZDMMKT-UHFFFAOYSA-N
MW227.38 g/mol
LogP2.84
Rot. Bonds5

About 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine

5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine (PubChem CID 103360689) has the molecular formula C11H21N3S and a molecular weight of 227.38 g/mol. Its IUPAC name is 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine
PubChem CID103360689
Molecular FormulaC11H21N3S
Molecular Weight227.38 g/mol
Exact Mass227.15
IUPAC Name5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine
SMILESCC(C)CN(CC(C)C)c1cc(N)ns1
InChIInChI=1S/C11H21N3S/c1-8(2)6-14(7-9(3)4)11-5-10(12)13-15-11/h5,8-9H,6-7H2,1-4H3,(H2,12,13)
InChIKeyPKBOIHZTZDMMKT-UHFFFAOYSA-N
XLogP2.84
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine 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

5-N-butan-2-yl-5-N-methyl-1,2-thiazole-3,5-diamine
CID 103362584
2-[(3-amino-1,2-thiazol-5-yl)-(2-hydroxyethyl)amino]ethanol
CID 103360679
5-N-(2-ethoxyethyl)-5-N-ethyl-1,2-thiazole-3,5-diamine
CID 103362970
1-[(3-amino-1,2-thiazol-5-yl)-methylamino]-3-methoxypropan-2-ol
CID 103361844
5-N-[3-(dimethylamino)propyl]-5-N-methyl-1,2-thiazole-3,5-diamine
CID 103362990
4-N,4-N-bis(2-methylpropyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771018
5-N-[(4-bromophenyl)methyl]-5-N-methyl-1,2-thiazole-3,5-diamine
CID 103361896
5-N-[[1-(dimethylamino)cyclobutyl]methyl]-5-N-methyl-1,2-thiazole-3,5-diamine
CID 103365871
5-N-cyclopentyl-5-N-ethyl-1,2-thiazole-3,5-diamine
CID 103360437
3-amino-5-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-1,2-thiazole-4-carbonitrile
CID 103379736
4-N-ethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80776167
6-N,6-N-dimethyl-4-N,4-N-bis(2-methylpropyl)pyrimidine-4,5,6-triamine
CID 19136904

Frequently Asked Questions

What is the IUPAC name of 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine (CID 103360689) is 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine is CC(C)CN(CC(C)C)c1cc(N)ns1.
What is the InChIKey of 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The InChIKey is PKBOIHZTZDMMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3S/c1-8(2)6-14(7-9(3)4)11-5-10(12)13-15-11/h5,8-9H,6-7H2,1-4H3,(H2,12,13).
What are the key properties of 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine?
5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine has a molecular weight of 227.38 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,5-N-bis(2-methylpropyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103360689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).