4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide

C20H19N3O2 — CID 133477197

IUPAC4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide
SMILESNC(=O)c1cnccc1NCC(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H19N3O2/c21-20(25)17-12-22-11-10-18(17)23-13-19(24)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-12,19,24H,13H2,(H2,21,25)(H,22,23)
InChIKeyCCRUSTFBPMFSHZ-UHFFFAOYSA-N
MW333.39 g/mol
LogP2.99
Rot. Bonds6

About 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide

4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide (PubChem CID 133477197) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide
PubChem CID133477197
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide
SMILESNC(=O)c1cnccc1NCC(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H19N3O2/c21-20(25)17-12-22-11-10-18(17)23-13-19(24)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-12,19,24H,13H2,(H2,21,25)(H,22,23)
InChIKeyCCRUSTFBPMFSHZ-UHFFFAOYSA-N
XLogP2.99
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(dimethylamino)-2-(4-methylphenyl)ethyl]amino]pyridine-3-carboxamide
CID 133468935
4-(2-hydroxypentylamino)pyridine-3-carboxamide
CID 133454771
2-[(3-chloro-4-pyridinyl)amino]-1-phenylethanol
CID 79839104
4-[[2-(4-chlorophenyl)phenyl]methylamino]pyridine-3-carboxamide
CID 133469856
4-[[2-hydroxy-3-(4-iodophenoxy)propyl]amino]pyridine-3-carboxamide
CID 133469940
4-[(3-phenoxyphenyl)methylamino]pyridine-3-carboxamide
CID 133442189
2-(4-aminoanilino)-1-(4-phenylphenyl)ethanol
CID 155758987
2-[(6-methylpyrazin-2-yl)amino]-1-(4-phenylphenyl)ethanol
CID 133477153
6-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]-N-prop-2-ynylpyridine-3-carboxamide
CID 133477137
4-[(4-tert-butylphenyl)methylamino]pyridine-3-carboxamide
CID 133469009
4-[(2-ethoxyphenyl)methylamino]pyridine-3-carboxamide
CID 133468437
4-[(6-methyl-2-pyridinyl)methylamino]pyridine-3-carboxamide
CID 133442516

Frequently Asked Questions

What is the IUPAC name of 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide?
The IUPAC name of 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide (CID 133477197) is 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide is NC(=O)c1cnccc1NCC(O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide?
The InChIKey is CCRUSTFBPMFSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c21-20(25)17-12-22-11-10-18(17)23-13-19(24)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-12,19,24H,13H2,(H2,21,25)(H,22,23).
What are the key properties of 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide?
4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 2.99, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-hydroxy-2-(4-phenylphenyl)ethyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 133477197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).