carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine

C7H10N2O3S — CID 88600251

IUPACcarbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine
SMILESC/C=C\c1csc(N)n1.O=C(O)O
InChIInChI=1S/C6H8N2S.CH2O3/c1-2-3-5-4-9-6(7)8-5;2-1(3)4/h2-4H,1H3,(H2,7,8);(H2,2,3,4)/b3-2-;
InChIKeyQNRQQCSYSGKYAO-OLGQORCHSA-N
MW202.24 g/mol
LogP1.98
Rot. Bonds1

About carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine

carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine (PubChem CID 88600251) has the molecular formula C7H10N2O3S and a molecular weight of 202.24 g/mol. Its IUPAC name is carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Namecarbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine
PubChem CID88600251
Molecular FormulaC7H10N2O3S
Molecular Weight202.24 g/mol
Exact Mass202.04
IUPAC Namecarbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine
SMILESC/C=C\c1csc(N)n1.O=C(O)O
InChIInChI=1S/C6H8N2S.CH2O3/c1-2-3-5-4-9-6(7)8-5;2-1(3)4/h2-4H,1H3,(H2,7,8);(H2,2,3,4)/b3-2-;
InChIKeyQNRQQCSYSGKYAO-OLGQORCHSA-N
XLogP1.98
TPSA96.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine?
The IUPAC name of carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine (CID 88600251) is carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine.
What is the SMILES notation for carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine?
The canonical SMILES for carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine is C/C=C\c1csc(N)n1.O=C(O)O.
What is the InChIKey of carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine?
The InChIKey is QNRQQCSYSGKYAO-OLGQORCHSA-N. The full InChI is InChI=1S/C6H8N2S.CH2O3/c1-2-3-5-4-9-6(7)8-5;2-1(3)4/h2-4H,1H3,(H2,7,8);(H2,2,3,4)/b3-2-;.
What are the key properties of carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine?
carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine has a molecular weight of 202.24 g/mol, XLogP of 1.98, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;4-[(Z)-prop-1-enyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 88600251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).