N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide

C14H20IN3O2 — CID 91465686

IUPACN-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cc(I)cc(N2CCOCC2)n1
InChIInChI=1S/C14H20IN3O2/c1-14(2,3)13(19)17-11-8-10(15)9-12(16-11)18-4-6-20-7-5-18/h8-9H,4-7H2,1-3H3,(H,16,17,19)
InChIKeyHQHRARDQBLDWJN-UHFFFAOYSA-N
MW389.24 g/mol
LogP2.51
Rot. Bonds2

About N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide

N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide (PubChem CID 91465686) has the molecular formula C14H20IN3O2 and a molecular weight of 389.24 g/mol. Its IUPAC name is N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide
PubChem CID91465686
Molecular FormulaC14H20IN3O2
Molecular Weight389.24 g/mol
Exact Mass389.06
IUPAC NameN-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cc(I)cc(N2CCOCC2)n1
InChIInChI=1S/C14H20IN3O2/c1-14(2,3)13(19)17-11-8-10(15)9-12(16-11)18-4-6-20-7-5-18/h8-9H,4-7H2,1-3H3,(H,16,17,19)
InChIKeyHQHRARDQBLDWJN-UHFFFAOYSA-N
XLogP2.51
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.24
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-tert-butyl-4-iodo-6-morpholin-4-ylpyridin-2-amine;4-(6-fluoro-4-iodo-2-pyridinyl)morpholine;2-methylpropan-2-amine
CID 158649137
2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
4-[4-iodo-6-(trifluoromethyl)-2-pyridinyl]morpholine
CID 162764791
4-(6-fluoro-4-iodo-2-pyridinyl)morpholine;4-iodo-N-[(2S)-2-methoxypropyl]-6-morpholin-4-ylpyridin-2-amine;(2S)-2-methoxypropan-1-amine;sulfane
CID 157234853
(2R)-2-[(4-iodo-6-morpholin-4-yl-2-pyridinyl)oxy]propan-1-ol
CID 155160945
2,2-dimethyl-N-(3-morpholin-4-ylphenyl)propanamide
CID 47342308
N,4-dimethyl-6-morpholin-4-ylpyridin-2-amine;ethane
CID 177153014
N-(5-fluoro-2-morpholin-4-ylphenyl)-2,2-dimethylpropanamide
CID 113092676
N-(3-bromo-4-morpholin-4-ylphenyl)-2,2-dimethylpropanamide
CID 17220722
propan-2-yl 2-[[6-morpholin-4-yl-2-[(2-oxo-2-propan-2-yloxyacetyl)amino]pyrimidin-4-yl]amino]-2-oxoacetate
CID 14097514
(2S)-1-[(4-iodo-6-morpholin-4-yl-2-pyridinyl)oxy]propan-2-ol
CID 155160455
4-amino-1-methylcyclohexan-1-ol;4-(6-fluoro-4-iodo-2-pyridinyl)morpholine;4-[(4-iodo-6-morpholin-4-yl-2-pyridinyl)amino]-1-methylcyclohexan-1-ol
CID 159954649

Frequently Asked Questions

What is the IUPAC name of N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide (CID 91465686) is N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cc(I)cc(N2CCOCC2)n1.
What is the InChIKey of N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide?
The InChIKey is HQHRARDQBLDWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20IN3O2/c1-14(2,3)13(19)17-11-8-10(15)9-12(16-11)18-4-6-20-7-5-18/h8-9H,4-7H2,1-3H3,(H,16,17,19).
What are the key properties of N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide?
N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide has a molecular weight of 389.24 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodo-6-morpholin-4-yl-2-pyridinyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 91465686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).