N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide

C14H22N4O2 — CID 138010874

IUPACN-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide
SMILESCn1ccnc1COCC(=O)NC1CCNC12CCC2
InChIInChI=1S/C14H22N4O2/c1-18-8-7-15-12(18)9-20-10-13(19)17-11-3-6-16-14(11)4-2-5-14/h7-8,11,16H,2-6,9-10H2,1H3,(H,17,19)
InChIKeyRMHUMCDXTXCUQS-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.34
Rot. Bonds5

About N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide

N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide (PubChem CID 138010874) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide
PubChem CID138010874
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide
SMILESCn1ccnc1COCC(=O)NC1CCNC12CCC2
InChIInChI=1S/C14H22N4O2/c1-18-8-7-15-12(18)9-20-10-13(19)17-11-3-6-16-14(11)4-2-5-14/h7-8,11,16H,2-6,9-10H2,1H3,(H,17,19)
InChIKeyRMHUMCDXTXCUQS-UHFFFAOYSA-N
XLogP0.34
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-[[(3R,4S)-1-[(1-methylimidazol-2-yl)methyl]-4-propan-2-ylpyrrolidin-3-yl]amino]-2-oxoethoxy]acetamide
CID 72855409
N-[(3R*,4S*)-4-cyclopropyl-1-(methoxyacetyl)pyrrolidin-3-yl]-3-(2-ethyl-1H-imidazol-1-yl)propanamide
CID 72842071
N-[(7S)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl]-1-ethoxycyclopentane-1-carboxamide
CID 164631751
N-(2-amino-1-cyclopentylethyl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid
CID 167787338
2-(difluoromethoxy)-N-[[6-[2-[(1-methylimidazol-2-yl)methoxy]acetyl]-6-azaspiro[3.4]octan-7-yl]methyl]acetamide
CID 167833764
2-(2-methylimidazol-1-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 30704696
2-Methoxy-1-[4-[(1-methylimidazol-2-yl)methylamino]piperidin-1-yl]ethanone
CID 55065018
2-ethoxy-N-(2-imidazol-1-ylcyclopentyl)acetamide
CID 60778466
1-[4-[(1-Ethylimidazol-2-yl)methylamino]piperidin-1-yl]-2-methoxyethanone
CID 62352239
2-Methoxy-1-[4-[(1-propylimidazol-2-yl)methylamino]piperidin-1-yl]ethanone
CID 62955618
2-Methoxy-1-[4-[1-(1-methylimidazol-2-yl)ethylamino]piperidin-1-yl]ethanone
CID 64179544
2-hydroxy-N-(rel-(3R,4S)-4-isopropyl-1-{[1-(2-methoxyethyl)-1H-imidazol-2-yl]methyl}-3-pyrrolidinyl)acetamide dihydrochloride
CID 72850748

Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide?
The IUPAC name of N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide (CID 138010874) is N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide.
What is the SMILES notation for N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide?
The canonical SMILES for N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide is Cn1ccnc1COCC(=O)NC1CCNC12CCC2.
What is the InChIKey of N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide?
The InChIKey is RMHUMCDXTXCUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-18-8-7-15-12(18)9-20-10-13(19)17-11-3-6-16-14(11)4-2-5-14/h7-8,11,16H,2-6,9-10H2,1H3,(H,17,19).
What are the key properties of N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide?
N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide has a molecular weight of 278.36 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azaspiro[3.4]octan-8-yl)-2-[(1-methylimidazol-2-yl)methoxy]acetamide is sourced from PubChem (CID 138010874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).