N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide

C15H15ClN2O3 — CID 97320910

IUPACN-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide
SMILESCO[C@@H](CNC(=O)c1ccncc1O)c1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O3/c1-21-14(10-3-2-4-11(16)7-10)9-18-15(20)12-5-6-17-8-13(12)19/h2-8,14,19H,9H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeyVDENJALLSXDJAX-AWEZNQCLSA-N
MW306.75 g/mol
LogP2.56
Rot. Bonds5

About N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide

N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide (PubChem CID 97320910) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide
PubChem CID97320910
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC NameN-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide
SMILESCO[C@@H](CNC(=O)c1ccncc1O)c1cccc(Cl)c1
InChIInChI=1S/C15H15ClN2O3/c1-21-14(10-3-2-4-11(16)7-10)9-18-15(20)12-5-6-17-8-13(12)19/h2-8,14,19H,9H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeyVDENJALLSXDJAX-AWEZNQCLSA-N
XLogP2.56
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide (CID 97320910) is N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide is CO[C@@H](CNC(=O)c1ccncc1O)c1cccc(Cl)c1.
What is the InChIKey of N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide?
The InChIKey is VDENJALLSXDJAX-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-21-14(10-3-2-4-11(16)7-10)9-18-15(20)12-5-6-17-8-13(12)19/h2-8,14,19H,9H2,1H3,(H,18,20)/t14-/m0/s1.
What are the key properties of N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide?
N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 97320910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).