N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide

C17H26N2O3 — CID 131683019

IUPACN-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide
SMILESO=C(NC1CCC1)C1CC12CCN(C(=O)CC1(O)CCC1)C2
InChIInChI=1S/C17H26N2O3/c20-14(10-17(22)5-2-6-17)19-8-7-16(11-19)9-13(16)15(21)18-12-3-1-4-12/h12-13,22H,1-11H2,(H,18,21)
InChIKeyONRWFABEEIOIJM-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.20
Rot. Bonds4

About N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide

N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide (PubChem CID 131683019) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide.

Molecular Properties

Compound NameN-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide
PubChem CID131683019
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide
SMILESO=C(NC1CCC1)C1CC12CCN(C(=O)CC1(O)CCC1)C2
InChIInChI=1S/C17H26N2O3/c20-14(10-17(22)5-2-6-17)19-8-7-16(11-19)9-13(16)15(21)18-12-3-1-4-12/h12-13,22H,1-11H2,(H,18,21)
InChIKeyONRWFABEEIOIJM-UHFFFAOYSA-N
XLogP1.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-5-[2-(2-oxo-1-pyridinyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide
CID 155872159
N-cyclobutyl-5-(3-hydroxycyclobutanecarbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 131682925
N-cyclobutyl-5-(1H-pyrazole-5-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 131683126
(2S,3R)-N-cyclopropyl-5-(5-methylpyrazine-2-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 97493284
(2R,3R)-N-cyclopropyl-5-(5-methylpyrazine-2-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 97493286
N-cyclobutyl-5-(3-methoxy-1,2-oxazole-5-carbonyl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 131683110
(2S)-N-cyclobutyl-6-(5-methylpyrazine-2-carbonyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 97493493
2-cyclopentyl-N-[1-[2-(1-hydroxycyclopentyl)acetyl]piperidin-4-yl]acetamide
CID 111538308
(2R,3R)-N-cyclobutyl-5-(1,3,4-thiadiazol-2-yl)-5-azaspiro[2.4]heptane-2-carboxamide
CID 98778397
(2S,3R)-5-N-cyclohexyl-2-N-(thiophen-2-ylmethyl)-5-azaspiro[2.4]heptane-2,5-dicarboxamide
CID 97493408
N-(cyclopropylmethyl)-8-[2-(1-hydroxycyclobutyl)acetyl]-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 131690745
2-cyclohexyl-1-[4-[2-(1-hydroxycyclopentyl)acetyl]piperazin-1-yl]ethanone
CID 111537735

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide?
The IUPAC name of N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide (CID 131683019) is N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide.
What is the SMILES notation for N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide?
The canonical SMILES for N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide is O=C(NC1CCC1)C1CC12CCN(C(=O)CC1(O)CCC1)C2.
What is the InChIKey of N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide?
The InChIKey is ONRWFABEEIOIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c20-14(10-17(22)5-2-6-17)19-8-7-16(11-19)9-13(16)15(21)18-12-3-1-4-12/h12-13,22H,1-11H2,(H,18,21).
What are the key properties of N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide?
N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-5-[2-(1-hydroxycyclobutyl)acetyl]-5-azaspiro[2.4]heptane-2-carboxamide is sourced from PubChem (CID 131683019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).