N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine

C17H24N4OS — CID 124997675

IUPACN,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
SMILESCN(C)c1cc(CC[C@@H]2CN(Cc3nccs3)CCO2)ccn1
InChIInChI=1S/C17H24N4OS/c1-20(2)16-11-14(5-6-18-16)3-4-15-12-21(8-9-22-15)13-17-19-7-10-23-17/h5-7,10-11,15H,3-4,8-9,12-13H2,1-2H3/t15-/m1/s1
InChIKeyRCAVGIUYOJQCOP-OAHLLOKOSA-N
MW332.47 g/mol
LogP2.44
Rot. Bonds6

About N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine

N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine (PubChem CID 124997675) has the molecular formula C17H24N4OS and a molecular weight of 332.47 g/mol. Its IUPAC name is N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
PubChem CID124997675
Molecular FormulaC17H24N4OS
Molecular Weight332.47 g/mol
Exact Mass332.17
IUPAC NameN,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
SMILESCN(C)c1cc(CC[C@@H]2CN(Cc3nccs3)CCO2)ccn1
InChIInChI=1S/C17H24N4OS/c1-20(2)16-11-14(5-6-18-16)3-4-15-12-21(8-9-22-15)13-17-19-7-10-23-17/h5-7,10-11,15H,3-4,8-9,12-13H2,1-2H3/t15-/m1/s1
InChIKeyRCAVGIUYOJQCOP-OAHLLOKOSA-N
XLogP2.44
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine?
The IUPAC name of N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine (CID 124997675) is N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine?
The canonical SMILES for N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine is CN(C)c1cc(CC[C@@H]2CN(Cc3nccs3)CCO2)ccn1.
What is the InChIKey of N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine?
The InChIKey is RCAVGIUYOJQCOP-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H24N4OS/c1-20(2)16-11-14(5-6-18-16)3-4-15-12-21(8-9-22-15)13-17-19-7-10-23-17/h5-7,10-11,15H,3-4,8-9,12-13H2,1-2H3/t15-/m1/s1.
What are the key properties of N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine?
N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine has a molecular weight of 332.47 g/mol, XLogP of 2.44, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[2-[(2R)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine is sourced from PubChem (CID 124997675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).