N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine

C17H24N4OS — CID 124739186

IUPACN-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine
SMILESCC(C)N(C)c1ccc(CN2CCO[C@@H](c3nccs3)C2)cn1
InChIInChI=1S/C17H24N4OS/c1-13(2)20(3)16-5-4-14(10-19-16)11-21-7-8-22-15(12-21)17-18-6-9-23-17/h4-6,9-10,13,15H,7-8,11-12H2,1-3H3/t15-/m1/s1
InChIKeySENWPQFYIAFUQO-OAHLLOKOSA-N
MW332.47 g/mol
LogP2.96
Rot. Bonds5

About N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine

N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine (PubChem CID 124739186) has the molecular formula C17H24N4OS and a molecular weight of 332.47 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine
PubChem CID124739186
Molecular FormulaC17H24N4OS
Molecular Weight332.47 g/mol
Exact Mass332.17
IUPAC NameN-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine
SMILESCC(C)N(C)c1ccc(CN2CCO[C@@H](c3nccs3)C2)cn1
InChIInChI=1S/C17H24N4OS/c1-13(2)20(3)16-5-4-14(10-19-16)11-21-7-8-22-15(12-21)17-18-6-9-23-17/h4-6,9-10,13,15H,7-8,11-12H2,1-3H3/t15-/m1/s1
InChIKeySENWPQFYIAFUQO-OAHLLOKOSA-N
XLogP2.96
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine?
The IUPAC name of N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine (CID 124739186) is N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine is CC(C)N(C)c1ccc(CN2CCO[C@@H](c3nccs3)C2)cn1.
What is the InChIKey of N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine?
The InChIKey is SENWPQFYIAFUQO-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H24N4OS/c1-13(2)20(3)16-5-4-14(10-19-16)11-21-7-8-22-15(12-21)17-18-6-9-23-17/h4-6,9-10,13,15H,7-8,11-12H2,1-3H3/t15-/m1/s1.
What are the key properties of N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine?
N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine has a molecular weight of 332.47 g/mol, XLogP of 2.96, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-5-[[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]methyl]pyridin-2-amine is sourced from PubChem (CID 124739186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).