3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide

C11H17N3O3S — CID 124751922

IUPAC3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCOC[C@H]1CO)Nc1nccs1
InChIInChI=1S/C11H17N3O3S/c15-7-9-8-17-5-4-14(9)3-1-10(16)13-11-12-2-6-18-11/h2,6,9,15H,1,3-5,7-8H2,(H,12,13,16)/t9-/m1/s1
InChIKeyHZKHHGMNFHHXHH-SECBINFHSA-N
MW271.34 g/mol
LogP0.16
Rot. Bonds5

About 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide

3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 124751922) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide
PubChem CID124751922
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCOC[C@H]1CO)Nc1nccs1
InChIInChI=1S/C11H17N3O3S/c15-7-9-8-17-5-4-14(9)3-1-10(16)13-11-12-2-6-18-11/h2,6,9,15H,1,3-5,7-8H2,(H,12,13,16)/t9-/m1/s1
InChIKeyHZKHHGMNFHHXHH-SECBINFHSA-N
XLogP0.16
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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3-(2-phenylmorpholin-4-yl)-N-(1,3-thiazol-2-yl)propanamide
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4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)butanamide
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N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]-3-piperidin-1-ylpropanamide
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Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide (CID 124751922) is 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide is O=C(CCN1CCOC[C@H]1CO)Nc1nccs1.
What is the InChIKey of 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is HZKHHGMNFHHXHH-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N3O3S/c15-7-9-8-17-5-4-14(9)3-1-10(16)13-11-12-2-6-18-11/h2,6,9,15H,1,3-5,7-8H2,(H,12,13,16)/t9-/m1/s1.
What are the key properties of 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide?
3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 271.34 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-3-(hydroxymethyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 124751922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).