N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide

C13H21N3O2 — CID 81442678

IUPACN-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide
SMILESCC(C)C(CN(C)C)NC(=O)c1ccncc1O
InChIInChI=1S/C13H21N3O2/c1-9(2)11(8-16(3)4)15-13(18)10-5-6-14-7-12(10)17/h5-7,9,11,17H,8H2,1-4H3,(H,15,18)
InChIKeyQRYBUQCVPUSUGC-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.10
Rot. Bonds5

About N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide

N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide (PubChem CID 81442678) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide
PubChem CID81442678
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide
SMILESCC(C)C(CN(C)C)NC(=O)c1ccncc1O
InChIInChI=1S/C13H21N3O2/c1-9(2)11(8-16(3)4)15-13(18)10-5-6-14-7-12(10)17/h5-7,9,11,17H,8H2,1-4H3,(H,15,18)
InChIKeyQRYBUQCVPUSUGC-UHFFFAOYSA-N
XLogP1.10
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-fluoropyridine-4-carboxamide
CID 115646512
4-[(3-hydroxypyridine-4-carbonyl)amino]pentanoic acid
CID 81445787
2-chloro-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyridine-3-carboxamide
CID 61479880
N-[1-(dimethylamino)-3-methylbutan-2-yl]-2-sulfanylbenzamide
CID 107025299
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)pyridine-3-carboxamide
CID 82949883
3-chloro-N-[1-(dimethylamino)propan-2-yl]pyridine-4-carboxamide
CID 82939115
3-hydroxy-N-[1-oxo-1-(propylamino)propan-2-yl]pyridine-4-carboxamide
CID 80707403
4-amino-N-[1-(dimethylamino)propan-2-yl]pyridine-3-carboxamide
CID 82950592
N-(1,1-dimethoxypropan-2-yl)-3-hydroxypyridine-4-carboxamide
CID 81445583
(2R)-2-[(3-hydroxypyridine-4-carbonyl)amino]butanoic acid
CID 81445874
N-(1-chloro-4-methylpentan-2-yl)-3-hydroxypyridine-4-carboxamide
CID 114300849
N-[1-(dimethylamino)-3-methylbutan-2-yl]-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105385519

Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide (CID 81442678) is N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide is CC(C)C(CN(C)C)NC(=O)c1ccncc1O.
What is the InChIKey of N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide?
The InChIKey is QRYBUQCVPUSUGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-9(2)11(8-16(3)4)15-13(18)10-5-6-14-7-12(10)17/h5-7,9,11,17H,8H2,1-4H3,(H,15,18).
What are the key properties of N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide?
N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 81442678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).