N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide

C18H24N4O3 — CID 99633921

IUPACN-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCC[C@H](NC(=O)c1cc(N2CCOCC2)ccn1)c1c(C)noc1C
InChIInChI=1S/C18H24N4O3/c1-4-15(17-12(2)21-25-13(17)3)20-18(23)16-11-14(5-6-19-16)22-7-9-24-10-8-22/h5-6,11,15H,4,7-10H2,1-3H3,(H,20,23)/t15-/m0/s1
InChIKeyWWBHFSXKQWRYHR-HNNXBMFYSA-N
MW344.42 g/mol
LogP2.40
Rot. Bonds5

About N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide

N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 99633921) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide
PubChem CID99633921
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCC[C@H](NC(=O)c1cc(N2CCOCC2)ccn1)c1c(C)noc1C
InChIInChI=1S/C18H24N4O3/c1-4-15(17-12(2)21-25-13(17)3)20-18(23)16-11-14(5-6-19-16)22-7-9-24-10-8-22/h5-6,11,15H,4,7-10H2,1-3H3,(H,20,23)/t15-/m0/s1
InChIKeyWWBHFSXKQWRYHR-HNNXBMFYSA-N
XLogP2.40
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide (CID 99633921) is N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide is CC[C@H](NC(=O)c1cc(N2CCOCC2)ccn1)c1c(C)noc1C.
What is the InChIKey of N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is WWBHFSXKQWRYHR-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-4-15(17-12(2)21-25-13(17)3)20-18(23)16-11-14(5-6-19-16)22-7-9-24-10-8-22/h5-6,11,15H,4,7-10H2,1-3H3,(H,20,23)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide?
N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-4-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 99633921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).