6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide

C16H22N4O3 — CID 167808743

IUPAC6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCC2CC3(CCNCC3)C(=O)O2)cn1
InChIInChI=1S/C16H22N4O3/c1-17-13-3-2-11(9-19-13)14(21)20-10-12-8-16(15(22)23-12)4-6-18-7-5-16/h2-3,9,12,18H,4-8,10H2,1H3,(H,17,19)(H,20,21)
InChIKeyCZRZXQAUZSFUAO-UHFFFAOYSA-N
MW318.38 g/mol
LogP0.54
Rot. Bonds4

About 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide

6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide (PubChem CID 167808743) has the molecular formula C16H22N4O3 and a molecular weight of 318.38 g/mol. Its IUPAC name is 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide
PubChem CID167808743
Molecular FormulaC16H22N4O3
Molecular Weight318.38 g/mol
Exact Mass318.17
IUPAC Name6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCC2CC3(CCNCC3)C(=O)O2)cn1
InChIInChI=1S/C16H22N4O3/c1-17-13-3-2-11(9-19-13)14(21)20-10-12-8-16(15(22)23-12)4-6-18-7-5-16/h2-3,9,12,18H,4-8,10H2,1H3,(H,17,19)(H,20,21)
InChIKeyCZRZXQAUZSFUAO-UHFFFAOYSA-N
XLogP0.54
TPSA92.35 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
CID 167808742
6-bromo-4-methyl-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide
CID 166409383
5-bromo-3-methyl-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-2-carboxamide
CID 166261774
2-oxo-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]-1H-pyrazine-3-carboxamide
CID 166358858
5-bromo-4-chloro-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-2-carboxamide
CID 167840056
6-chloro-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]-1H-pyrazolo[5,4-b]pyridine-4-carboxamide
CID 166429571
6-bromo-4-methyl-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-2-carboxamide
CID 166415854
5-iodo-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]-1H-indazole-3-carboxamide
CID 166358741
7-chloro-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]quinoline-4-carboxamide;2,2,2-trifluoroacetic acid
CID 166261782
4-bromo-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]thieno[2,3-c]pyridine-2-carboxamide
CID 166358651
5-bromo-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]-2,1-benzothiazole-3-carboxamide
CID 166358868
6-bromo-4-oxo-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]-1H-quinoline-3-carboxamide
CID 166358857

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide (CID 167808743) is 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide is CNc1ccc(C(=O)NCC2CC3(CCNCC3)C(=O)O2)cn1.
What is the InChIKey of 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide?
The InChIKey is CZRZXQAUZSFUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O3/c1-17-13-3-2-11(9-19-13)14(21)20-10-12-8-16(15(22)23-12)4-6-18-7-5-16/h2-3,9,12,18H,4-8,10H2,1H3,(H,17,19)(H,20,21).
What are the key properties of 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide?
6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-[(1-oxo-2-oxa-8-azaspiro[4.5]decan-3-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 167808743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).