N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine

C14H23N5OS — CID 97274513

IUPACN,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
SMILESCc1nn(C)c2nc(N(C)C[C@@H](C)N3CCOCC3)sc12
InChIInChI=1S/C14H23N5OS/c1-10(19-5-7-20-8-6-19)9-17(3)14-15-13-12(21-14)11(2)16-18(13)4/h10H,5-9H2,1-4H3/t10-/m1/s1
InChIKeyZDTHXUJOKRGKNN-SNVBAGLBSA-N
MW309.44 g/mol
LogP1.50
Rot. Bonds4

About N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine

N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine (PubChem CID 97274513) has the molecular formula C14H23N5OS and a molecular weight of 309.44 g/mol. Its IUPAC name is N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
PubChem CID97274513
Molecular FormulaC14H23N5OS
Molecular Weight309.44 g/mol
Exact Mass309.16
IUPAC NameN,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine
SMILESCc1nn(C)c2nc(N(C)C[C@@H](C)N3CCOCC3)sc12
InChIInChI=1S/C14H23N5OS/c1-10(19-5-7-20-8-6-19)9-17(3)14-15-13-12(21-14)11(2)16-18(13)4/h10H,5-9H2,1-4H3/t10-/m1/s1
InChIKeyZDTHXUJOKRGKNN-SNVBAGLBSA-N
XLogP1.50
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.44
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The IUPAC name of N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine (CID 97274513) is N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine.
What is the SMILES notation for N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The canonical SMILES for N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine is Cc1nn(C)c2nc(N(C)C[C@@H](C)N3CCOCC3)sc12.
What is the InChIKey of N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
The InChIKey is ZDTHXUJOKRGKNN-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H23N5OS/c1-10(19-5-7-20-8-6-19)9-17(3)14-15-13-12(21-14)11(2)16-18(13)4/h10H,5-9H2,1-4H3/t10-/m1/s1.
What are the key properties of N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine?
N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine has a molecular weight of 309.44 g/mol, XLogP of 1.50, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-N-[(2R)-2-morpholin-4-ylpropyl]pyrazolo[5,4-d][1,3]thiazol-5-amine is sourced from PubChem (CID 97274513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).