2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide

C19H21FN2O3 — CID 91790696

IUPAC2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(C(NC(=O)Cc2ccccc2F)C2CC(O)C2)cn1
InChIInChI=1S/C19H21FN2O3/c1-25-18-7-6-13(11-21-18)19(14-8-15(23)9-14)22-17(24)10-12-4-2-3-5-16(12)20/h2-7,11,14-15,19,23H,8-10H2,1H3,(H,22,24)
InChIKeySZQDBZXASFNQJH-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.40
Rot. Bonds6

About 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide

2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide (PubChem CID 91790696) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
PubChem CID91790696
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(C(NC(=O)Cc2ccccc2F)C2CC(O)C2)cn1
InChIInChI=1S/C19H21FN2O3/c1-25-18-7-6-13(11-21-18)19(14-8-15(23)9-14)22-17(24)10-12-4-2-3-5-16(12)20/h2-7,11,14-15,19,23H,8-10H2,1H3,(H,22,24)
InChIKeySZQDBZXASFNQJH-UHFFFAOYSA-N
XLogP2.40
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-difluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91783663
2-(2,4-difluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91785366
2-(2-chloro-6-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91772588
2-(4-chlorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91760458
2-cyclopentyl-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 91772366
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 91766472
2,3-difluoro-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-6-methoxybenzamide
CID 91768425
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide
CID 136662146
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 91773303
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]quinoxaline-2-carboxamide
CID 91786632
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]thiophene-2-carboxamide
CID 91772790
N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]-6-methylpyridine-3-carboxamide
CID 91784748

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide (CID 91790696) is 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide is COc1ccc(C(NC(=O)Cc2ccccc2F)C2CC(O)C2)cn1.
What is the InChIKey of 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide?
The InChIKey is SZQDBZXASFNQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-25-18-7-6-13(11-21-18)19(14-8-15(23)9-14)22-17(24)10-12-4-2-3-5-16(12)20/h2-7,11,14-15,19,23H,8-10H2,1H3,(H,22,24).
What are the key properties of 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide?
2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide has a molecular weight of 344.39 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[(3-hydroxycyclobutyl)-(6-methoxy-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 91790696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).