(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine

C10H16N2OS — CID 130571376

IUPAC(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine
SMILESCOc1nc(C(N)C2CC2(C)C)cs1
InChIInChI=1S/C10H16N2OS/c1-10(2)4-6(10)8(11)7-5-14-9(12-7)13-3/h5-6,8H,4,11H2,1-3H3
InChIKeyWAMHKLGYZJTLAC-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.20
Rot. Bonds3

About (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine

(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine (PubChem CID 130571376) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine.

Molecular Properties

Compound Name(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine
PubChem CID130571376
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine
SMILESCOc1nc(C(N)C2CC2(C)C)cs1
InChIInChI=1S/C10H16N2OS/c1-10(2)4-6(10)8(11)7-5-14-9(12-7)13-3/h5-6,8H,4,11H2,1-3H3
InChIKeyWAMHKLGYZJTLAC-UHFFFAOYSA-N
XLogP2.20
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine?
The IUPAC name of (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine (CID 130571376) is (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine.
What is the SMILES notation for (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine?
The canonical SMILES for (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine is COc1nc(C(N)C2CC2(C)C)cs1.
What is the InChIKey of (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine?
The InChIKey is WAMHKLGYZJTLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-10(2)4-6(10)8(11)7-5-14-9(12-7)13-3/h5-6,8H,4,11H2,1-3H3.
What are the key properties of (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine?
(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine has a molecular weight of 212.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine is sourced from PubChem (CID 130571376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).