N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide

C16H30N2O2 — CID 102897648

IUPACN-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H30N2O2/c1-15(2,3)18-14(19)12-17-11-13-7-10-16(20-13)8-5-4-6-9-16/h13,17H,4-12H2,1-3H3,(H,18,19)
InChIKeyBUCZECMPSXTDQD-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.37
Rot. Bonds4

About N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide

N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide (PubChem CID 102897648) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide
PubChem CID102897648
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC1CCC2(CCCCC2)O1
InChIInChI=1S/C16H30N2O2/c1-15(2,3)18-14(19)12-17-11-13-7-10-16(20-13)8-5-4-6-9-16/h13,17H,4-12H2,1-3H3,(H,18,19)
InChIKeyBUCZECMPSXTDQD-UHFFFAOYSA-N
XLogP2.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-oxaspiro[4.4]nonan-2-ylmethylamino)-N-propan-2-ylacetamide
CID 102896860
N-(2-methoxyethyl)-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide
CID 102897739
2,2-dimethyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-1-amine
CID 102896955
2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)propan-2-amine
CID 102896742
2-bromo-N-(1-oxaspiro[4.5]decan-2-ylmethyl)prop-2-en-1-amine
CID 102897807
2-methyl-2-(1-oxaspiro[4.5]decan-2-ylmethylcarbamoylamino)propanoic acid
CID 102896511
N-tert-butyl-2-(oxan-2-ylmethylamino)acetamide
CID 60697952
2,3,3-trimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-amine
CID 102897716
3-(1-oxaspiro[4.4]nonan-2-ylmethylamino)propanoic acid
CID 102899126
methyl 2-chloro-3-(1-oxaspiro[4.5]decan-2-ylmethylamino)propanoate
CID 103491800
N-(2-methylpropyl)-3-(1-oxaspiro[4.5]decan-2-ylmethylamino)propanamide
CID 102897768
2-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)ethanamine
CID 102897426

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide (CID 102897648) is N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide is CC(C)(C)NC(=O)CNCC1CCC2(CCCCC2)O1.
What is the InChIKey of N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide?
The InChIKey is BUCZECMPSXTDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-15(2,3)18-14(19)12-17-11-13-7-10-16(20-13)8-5-4-6-9-16/h13,17H,4-12H2,1-3H3,(H,18,19).
What are the key properties of N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide?
N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide has a molecular weight of 282.43 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(1-oxaspiro[4.5]decan-2-ylmethylamino)acetamide is sourced from PubChem (CID 102897648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).