N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide

C14H18ClN3O2 — CID 126779195

IUPACN-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide
SMILESO=C(CN1CCOCC12CCC2)Nc1ccc(Cl)cn1
InChIInChI=1S/C14H18ClN3O2/c15-11-2-3-12(16-8-11)17-13(19)9-18-6-7-20-10-14(18)4-1-5-14/h2-3,8H,1,4-7,9-10H2,(H,16,17,19)
InChIKeyBTPTWLLVMBYKMD-UHFFFAOYSA-N
MW295.77 g/mol
LogP1.93
Rot. Bonds3

About N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide

N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide (PubChem CID 126779195) has the molecular formula C14H18ClN3O2 and a molecular weight of 295.77 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide
PubChem CID126779195
Molecular FormulaC14H18ClN3O2
Molecular Weight295.77 g/mol
Exact Mass295.11
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide
SMILESO=C(CN1CCOCC12CCC2)Nc1ccc(Cl)cn1
InChIInChI=1S/C14H18ClN3O2/c15-11-2-3-12(16-8-11)17-13(19)9-18-6-7-20-10-14(18)4-1-5-14/h2-3,8H,1,4-7,9-10H2,(H,16,17,19)
InChIKeyBTPTWLLVMBYKMD-UHFFFAOYSA-N
XLogP1.93
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)acetamide
CID 6467673
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N-(5-chloro-2-pyridinyl)-2-(4-ethylpiperazin-1-yl)acetamide
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N-(5-chloro-2-pyridinyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
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N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]acetamide
CID 94184594
N-(5-chloro-2-pyridinyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 110899282
N-(5-chloro-2-pyridinyl)-2-[(3S)-3-hydroxypyrrolidin-1-yl]acetamide
CID 111332524
N-(5-chloro-2-pyridinyl)-2-[(2S)-2-cyclohexylpyrrolidin-1-yl]acetamide
CID 95576835
N-(5-chloro-2-pyridinyl)-3-methyloxetane-3-carboxamide
CID 146022433
4-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethoxy]-N-morpholin-4-ylbenzamide
CID 141108855
N-(5-chloro-2-pyridinyl)-5-methyl-1,4-oxazepane-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide (CID 126779195) is N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide is O=C(CN1CCOCC12CCC2)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide?
The InChIKey is BTPTWLLVMBYKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3O2/c15-11-2-3-12(16-8-11)17-13(19)9-18-6-7-20-10-14(18)4-1-5-14/h2-3,8H,1,4-7,9-10H2,(H,16,17,19).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide?
N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide has a molecular weight of 295.77 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(8-oxa-5-azaspiro[3.5]nonan-5-yl)acetamide is sourced from PubChem (CID 126779195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).