2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide

C20H25N3O3 — CID 124755383

IUPAC2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC([C@H](O)c2ccccn2)CC1
InChIInChI=1S/C20H25N3O3/c1-26-18-8-3-2-6-16(18)22-19(24)14-23-12-9-15(10-13-23)20(25)17-7-4-5-11-21-17/h2-8,11,15,20,25H,9-10,12-14H2,1H3,(H,22,24)/t20-/m0/s1
InChIKeyQFTICFCYJKTHNK-FQEVSTJZSA-N
MW355.44 g/mol
LogP2.47
Rot. Bonds6

About 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide

2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide (PubChem CID 124755383) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
PubChem CID124755383
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCC([C@H](O)c2ccccn2)CC1
InChIInChI=1S/C20H25N3O3/c1-26-18-8-3-2-6-16(18)22-19(24)14-23-12-9-15(10-13-23)20(25)17-7-4-5-11-21-17/h2-8,11,15,20,25H,9-10,12-14H2,1H3,(H,22,24)/t20-/m0/s1
InChIKeyQFTICFCYJKTHNK-FQEVSTJZSA-N
XLogP2.47
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide
CID 91839079
2-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(1-methylpyrazol-3-yl)acetamide
CID 91838124
2-[4-(2-methoxyanilino)piperidin-1-yl]-N-pyridin-2-ylacetamide
CID 10735928
N-(2-methoxyphenyl)-2-[4-[6-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]acetamide
CID 110095808
N-(2-methoxyphenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922615
4-[(S)-hydroxy(pyridin-2-yl)methyl]-N-[2-(2-methylprop-2-enoxy)phenyl]piperidine-1-carboxamide
CID 97455589
N-(2-ethylphenyl)-2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 9436558
N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
CID 34773711
1-[2-(2-methoxyanilino)-2-oxoethyl]-N-methylpyrrolidine-3-carboxamide
CID 171998883
N-cyclopropyl-1-[2-(2-methoxyanilino)-2-oxoethyl]pyrrolidine-3-carboxamide
CID 166601973
N-(2-acetamidophenyl)-2-[4-[(S)-hydroxy-(1-methylimidazol-2-yl)methyl]piperidin-1-yl]acetamide
CID 95133334
N-(2-methoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919921

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide (CID 124755383) is 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN1CCC([C@H](O)c2ccccn2)CC1.
What is the InChIKey of 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
The InChIKey is QFTICFCYJKTHNK-FQEVSTJZSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-26-18-8-3-2-6-16(18)22-19(24)14-23-12-9-15(10-13-23)20(25)17-7-4-5-11-21-17/h2-8,11,15,20,25H,9-10,12-14H2,1H3,(H,22,24)/t20-/m0/s1.
What are the key properties of 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide?
2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 2.47, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 124755383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).