N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide

C14H20N2O2 — CID 91781242

IUPACN-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide
SMILESCCC(NC(=O)Cc1ccncc1)C1CC(O)C1
InChIInChI=1S/C14H20N2O2/c1-2-13(11-8-12(17)9-11)16-14(18)7-10-3-5-15-6-4-10/h3-6,11-13,17H,2,7-9H2,1H3,(H,16,18)
InChIKeyBFUBIZCHKUJLFI-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.29
Rot. Bonds5

About N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide

N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide (PubChem CID 91781242) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide
PubChem CID91781242
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide
SMILESCCC(NC(=O)Cc1ccncc1)C1CC(O)C1
InChIInChI=1S/C14H20N2O2/c1-2-13(11-8-12(17)9-11)16-14(18)7-10-3-5-15-6-4-10/h3-6,11-13,17H,2,7-9H2,1H3,(H,16,18)
InChIKeyBFUBIZCHKUJLFI-UHFFFAOYSA-N
XLogP1.29
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-2-(1H-indol-3-yl)acetamide
CID 91777146
2-(1,3-benzodioxol-5-yl)-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]acetamide
CID 91761671
3-(2-fluorophenyl)-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]propanamide
CID 91766999
N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
CID 103961002
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 91786219
3-hydroxy-N-[1-(3-hydroxycyclobutyl)propyl]-2-methylbenzamide
CID 91791431
N-[1-(3-hydroxycyclobutyl)propyl]-5-(4-methoxyphenyl)furan-2-carboxamide
CID 91779351
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[1-(3-hydroxycyclobutyl)propyl]acetamide
CID 91773530
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-1,3-oxazole-5-carboxamide
CID 91764166
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-4-methoxy-2-methylbenzamide
CID 91771484
2-(benzimidazol-1-yl)-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]acetamide
CID 91785397
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-2-(methylamino)pyridine-4-carboxamide
CID 91763983

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide?
The IUPAC name of N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide (CID 91781242) is N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide is CCC(NC(=O)Cc1ccncc1)C1CC(O)C1.
What is the InChIKey of N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide?
The InChIKey is BFUBIZCHKUJLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-13(11-8-12(17)9-11)16-14(18)7-10-3-5-15-6-4-10/h3-6,11-13,17H,2,7-9H2,1H3,(H,16,18).
What are the key properties of N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide?
N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide is sourced from PubChem (CID 91781242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).