(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone

C14H24N2O2 — CID 165470181

IUPAC(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone
SMILESNC1CCC2(CC1)CN(C(=O)C1CCC1)CCO2
InChIInChI=1S/C14H24N2O2/c15-12-4-6-14(7-5-12)10-16(8-9-18-14)13(17)11-2-1-3-11/h11-12H,1-10,15H2
InChIKeyQRMPFSFEOSSDOF-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.29
Rot. Bonds1

About (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone

(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone (PubChem CID 165470181) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone.

Molecular Properties

Compound Name(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone
PubChem CID165470181
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone
SMILESNC1CCC2(CC1)CN(C(=O)C1CCC1)CCO2
InChIInChI=1S/C14H24N2O2/c15-12-4-6-14(7-5-12)10-16(8-9-18-14)13(17)11-2-1-3-11/h11-12H,1-10,15H2
InChIKeyQRMPFSFEOSSDOF-UHFFFAOYSA-N
XLogP1.29
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopropyl-[3-(1-oxa-4-azaspiro[5.6]dodecane-4-carbonyl)piperidin-1-yl]methanone
CID 102553114
(1,1-dioxothian-3-yl)-(1-oxa-4-azaspiro[5.5]undecan-4-yl)methanone
CID 122134875
6-oxa-9-azaspiro[4.5]decan-9-yl-[(1R,3R)-3-(trifluoromethyl)cyclohexyl]methanone
CID 97232339
6-oxa-9-azaspiro[4.5]decan-9-yl-[(1S,3R)-3-(trifluoromethyl)cyclohexyl]methanone
CID 97232340
cyclopentyl(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)methanone
CID 130972053
(4-aminopiperidin-1-yl)-cyclobutylmethanone
CID 16777962
2-(1-oxa-4-azaspiro[5.5]undecane-4-carbonyl)cyclobutane-1-carboxamide
CID 122134891
(4,4-difluorocyclohexyl)-(9-imino-9-oxo-1-oxa-9λ6-thia-4-azaspiro[5.5]undecan-4-yl)methanone
CID 146114590
cyclobutyl-[9-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]methanone
CID 131905481
cyclopentyl-[8-(cyclopropanecarbonyl)-1,12-dioxa-4,8-diazaspiro[5.6]dodecan-4-yl]methanone
CID 172884690
cyclobutyl-[8-(1,3,4-thiadiazol-2-yl)-1-oxa-4,8-diazaspiro[5.5]undecan-4-yl]methanone
CID 131650043
4-cyclopentylsulfonyl-1-oxa-4-azaspiro[5.5]undecan-9-amine
CID 165477996

Frequently Asked Questions

What is the IUPAC name of (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone?
The IUPAC name of (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone (CID 165470181) is (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone.
What is the SMILES notation for (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone?
The canonical SMILES for (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone is NC1CCC2(CC1)CN(C(=O)C1CCC1)CCO2.
What is the InChIKey of (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone?
The InChIKey is QRMPFSFEOSSDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c15-12-4-6-14(7-5-12)10-16(8-9-18-14)13(17)11-2-1-3-11/h11-12H,1-10,15H2.
What are the key properties of (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone?
(9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone has a molecular weight of 252.36 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (9-amino-1-oxa-4-azaspiro[5.5]undecan-4-yl)-cyclobutylmethanone is sourced from PubChem (CID 165470181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).