4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide

C16H19N3O2 — CID 63182907

IUPAC4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NC(CO)c2ccccc2)ccn1
InChIInChI=1S/C16H19N3O2/c1-19(2)16(21)14-10-13(8-9-17-14)18-15(11-20)12-6-4-3-5-7-12/h3-10,15,20H,11H2,1-2H3,(H,17,18)
InChIKeyYABOTWFPTCTVFW-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.93
Rot. Bonds5

About 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide

4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide (PubChem CID 63182907) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide
PubChem CID63182907
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NC(CO)c2ccccc2)ccn1
InChIInChI=1S/C16H19N3O2/c1-19(2)16(21)14-10-13(8-9-17-14)18-15(11-20)12-6-4-3-5-7-12/h3-10,15,20H,11H2,1-2H3,(H,17,18)
InChIKeyYABOTWFPTCTVFW-UHFFFAOYSA-N
XLogP1.93
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-hydroxybutan-2-ylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395737
N,N-dimethyl-4-(1-pyridin-2-ylethylamino)pyridine-2-carboxamide
CID 43397218
2-[(2-chloro-4-pyridinyl)amino]-2-phenylethanol
CID 103721804
4-(4-aminobutan-2-ylamino)-N,N-dimethylpyridine-2-carboxamide
CID 83180429
4-(dicyclopropylmethylamino)-N,N-dimethylpyridine-2-carboxamide
CID 61482684
4-[1-(4-fluorophenyl)ethylamino]-N,N-dimethylpyridine-2-carboxamide
CID 60704565
N,N-dimethyl-4-(1-thiophen-2-ylethylamino)pyridine-2-carboxamide
CID 43402714
N,N-dimethyl-4-(3-phenylpropylamino)pyridine-2-carboxamide
CID 60704743
4-[(1-amino-4-methylpentan-3-yl)amino]-N,N-dimethylpyridine-2-carboxamide
CID 106357616
4-[1-(furan-2-yl)propan-2-ylamino]-N,N-dimethylpyridine-2-carboxamide
CID 61043893
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
N,N-dimethyl-4-[[2-(methylamino)-2-oxoethyl]amino]pyridine-2-carboxamide
CID 43395819

Frequently Asked Questions

What is the IUPAC name of 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide (CID 63182907) is 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide is CN(C)C(=O)c1cc(NC(CO)c2ccccc2)ccn1.
What is the InChIKey of 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is YABOTWFPTCTVFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-19(2)16(21)14-10-13(8-9-17-14)18-15(11-20)12-6-4-3-5-7-12/h3-10,15,20H,11H2,1-2H3,(H,17,18).
What are the key properties of 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide?
4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-hydroxy-1-phenylethyl)amino]-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 63182907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).