2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine

C10H17N3S — CID 102768513

IUPAC2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine
SMILESCCC(CC1CC1)Nc1ncc(N)s1
InChIInChI=1S/C10H17N3S/c1-2-8(5-7-3-4-7)13-10-12-6-9(11)14-10/h6-8H,2-5,11H2,1H3,(H,12,13)
InChIKeyDXSMQLJKDVRLCA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.72
Rot. Bonds5

About 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine

2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine (PubChem CID 102768513) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine
PubChem CID102768513
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine
SMILESCCC(CC1CC1)Nc1ncc(N)s1
InChIInChI=1S/C10H17N3S/c1-2-8(5-7-3-4-7)13-10-12-6-9(11)14-10/h6-8H,2-5,11H2,1H3,(H,12,13)
InChIKeyDXSMQLJKDVRLCA-UHFFFAOYSA-N
XLogP2.72
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(1-methoxybutan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768548
2-N-(3-ethylpentan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768492
5-chloro-N-(1-cyclopropylbutan-2-yl)pyrimidin-2-amine
CID 79556553
4-bromo-N-(1-cyclopropylbutan-2-yl)-1,3-thiazol-2-amine
CID 79400384
2-[(5-amino-1,3-thiazol-2-yl)amino]propan-1-ol
CID 102767605
5-bromo-N-pentan-3-yl-1,3-thiazol-2-amine
CID 79026516
2-N-(1-ethylsulfanylpropan-2-yl)-1,3-thiazole-2,5-diamine
CID 102769066
2-N-(1-ethoxypropan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768135
6-N-(1-cyclopropylbutan-2-yl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718593
6-chloro-2-N-(1-cyclopropylbutan-2-yl)pyridine-2,3-diamine
CID 115474196
2-N-(2-methylcyclopropyl)-1,3-thiazole-2,5-diamine
CID 102768294
N-(1-cyclopropylbutan-2-yl)-3-methyl-[1,2]thiazolo[5,4-d]pyrimidin-4-amine
CID 114203179

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine (CID 102768513) is 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine is CCC(CC1CC1)Nc1ncc(N)s1.
What is the InChIKey of 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine?
The InChIKey is DXSMQLJKDVRLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-2-8(5-7-3-4-7)13-10-12-6-9(11)14-10/h6-8H,2-5,11H2,1H3,(H,12,13).
What are the key properties of 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine?
2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine has a molecular weight of 211.33 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-cyclopropylbutan-2-yl)-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102768513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).