N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide

C11H17N3O3 — CID 125438798

IUPACN-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide
SMILESCN(C)C[C@H](O)CNC(=O)c1ccc(O)cn1
InChIInChI=1S/C11H17N3O3/c1-14(2)7-9(16)6-13-11(17)10-4-3-8(15)5-12-10/h3-5,9,15-16H,6-7H2,1-2H3,(H,13,17)/t9-/m1/s1
InChIKeyZRGITLYWDQONGQ-SECBINFHSA-N
MW239.28 g/mol
LogP-0.56
Rot. Bonds5

About N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide

N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide (PubChem CID 125438798) has the molecular formula C11H17N3O3 and a molecular weight of 239.28 g/mol. Its IUPAC name is N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide
PubChem CID125438798
Molecular FormulaC11H17N3O3
Molecular Weight239.28 g/mol
Exact Mass239.13
IUPAC NameN-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide
SMILESCN(C)C[C@H](O)CNC(=O)c1ccc(O)cn1
InChIInChI=1S/C11H17N3O3/c1-14(2)7-9(16)6-13-11(17)10-4-3-8(15)5-12-10/h3-5,9,15-16H,6-7H2,1-2H3,(H,13,17)/t9-/m1/s1
InChIKeyZRGITLYWDQONGQ-SECBINFHSA-N
XLogP-0.56
TPSA85.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(dimethylamino)-2-hydroxypropyl]pyridine-3-carboxamide
CID 110281404
N,N-diethyl-5-hydroxypyridine-2-carboxamide
CID 67234300
5-bromo-N-[(2S)-2,3-dihydroxypropyl]pyridine-2-carboxamide
CID 124510748
N-[3-(dimethylamino)-2-hydroxypropyl]-2-methylbenzamide
CID 110281401
2-(4-chlorophenyl)-N-[3-(dimethylamino)-2-hydroxypropyl]acetamide
CID 110281459
N-[(2S)-3-(dimethylamino)-2-hydroxypropyl]-2-(methylamino)pyridine-3-carboxamide
CID 125436111
5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide
CID 115700916
N-[3-(dimethylamino)-2-hydroxypropyl]-2-methylpyrazole-3-carboxamide
CID 110281226
5-chloro-N-[2-(dimethylamino)propyl]pyrazine-2-carboxamide
CID 107246707
N-[3-(dimethylamino)-2-hydroxypropyl]-4-ethynylbenzamide
CID 134264407
N-[3-(dimethylamino)-2-hydroxypropyl]-2,4-difluorobenzamide
CID 110281414
2-chloro-N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-6-fluoro-3-methylbenzamide
CID 125438904

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide?
The IUPAC name of N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide (CID 125438798) is N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide is CN(C)C[C@H](O)CNC(=O)c1ccc(O)cn1.
What is the InChIKey of N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide?
The InChIKey is ZRGITLYWDQONGQ-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-14(2)7-9(16)6-13-11(17)10-4-3-8(15)5-12-10/h3-5,9,15-16H,6-7H2,1-2H3,(H,13,17)/t9-/m1/s1.
What are the key properties of N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide?
N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide has a molecular weight of 239.28 g/mol, XLogP of -0.56, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-3-(dimethylamino)-2-hydroxypropyl]-5-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 125438798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).