2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide

C13H21N3O2 — CID 115869951

IUPAC2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)NC(C)(C)CCO)ccn1
InChIInChI=1S/C13H21N3O2/c1-13(2,6-8-17)15-12(18)10-5-7-14-11(9-10)16(3)4/h5,7,9,17H,6,8H2,1-4H3,(H,15,18)
InChIKeyKDMQHHHZHDKSQR-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.04
Rot. Bonds5

About 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide

2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide (PubChem CID 115869951) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide
PubChem CID115869951
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)NC(C)(C)CCO)ccn1
InChIInChI=1S/C13H21N3O2/c1-13(2,6-8-17)15-12(18)10-5-7-14-11(9-10)16(3)4/h5,7,9,17H,6,8H2,1-4H3,(H,15,18)
InChIKeyKDMQHHHZHDKSQR-UHFFFAOYSA-N
XLogP1.04
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 ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide
CID 115870175
2-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 84574435
2-[[2-(dimethylamino)pyridine-4-carbonyl]amino]-3-hydroxypropanoic acid
CID 43171682
4-tert-butyl-N-(4-hydroxy-2-methylbutan-2-yl)benzamide
CID 115870121
N-(3-amino-2-hydroxy-3-oxopropyl)-2-(dimethylamino)pyridine-4-carboxamide
CID 114152484
N-tert-butyl-2-(dipropylamino)pyridine-4-carboxamide
CID 109174998
2-(dimethylamino)-N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
CID 103799343
2,6-dichloro-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide
CID 115969021
N-(4-hydroxy-2-methylbutan-2-yl)furan-3-carboxamide
CID 115869863
6-bromo-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-3-carboxamide
CID 115968711
2-(dimethylamino)-N-[4-(hydroxymethyl)oxan-4-yl]pyridine-4-carboxamide
CID 103954232
2-(dimethylamino)-N-[(3-hydroxycyclobutyl)methyl]pyridine-4-carboxamide
CID 66006489

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide (CID 115869951) is 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide is CN(C)c1cc(C(=O)NC(C)(C)CCO)ccn1.
What is the InChIKey of 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide?
The InChIKey is KDMQHHHZHDKSQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-13(2,6-8-17)15-12(18)10-5-7-14-11(9-10)16(3)4/h5,7,9,17H,6,8H2,1-4H3,(H,15,18).
What are the key properties of 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide?
2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(4-hydroxy-2-methylbutan-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 115869951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).