3-amino-1-methoxycyclobutane-1-carboxamide

C6H12N2O2 — CID 142554999

IUPAC3-amino-1-methoxycyclobutane-1-carboxamide
SMILESCOC1(C(N)=O)CC(N)C1
InChIInChI=1S/C6H12N2O2/c1-10-6(5(8)9)2-4(7)3-6/h4H,2-3,7H2,1H3,(H2,8,9)
InChIKeyZSXCNCAFWCSTDP-UHFFFAOYSA-N
MW144.17 g/mol
LogP-1.02
Rot. Bonds2

About 3-amino-1-methoxycyclobutane-1-carboxamide

3-amino-1-methoxycyclobutane-1-carboxamide (PubChem CID 142554999) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 3-amino-1-methoxycyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-amino-1-methoxycyclobutane-1-carboxamide
PubChem CID142554999
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name3-amino-1-methoxycyclobutane-1-carboxamide
SMILESCOC1(C(N)=O)CC(N)C1
InChIInChI=1S/C6H12N2O2/c1-10-6(5(8)9)2-4(7)3-6/h4H,2-3,7H2,1H3,(H2,8,9)
InChIKeyZSXCNCAFWCSTDP-UHFFFAOYSA-N
XLogP-1.02
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-1.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-1-methylpiperidine-4-carboxamide
CID 89303192
3-[3,4-bis(ethenyl)-2,5-dioxopyrrol-1-yl]-1-methoxycyclobutane-1-carboxamide
CID 142554994
1-methoxycyclobutane-1-carboxamide;1-methoxy-N-methylcyclobutane-1-carboxamide
CID 160973197
[(1S,3S)-3-amino-1-carbamoylcyclopentyl] 2,2,2-trifluoroacetate
CID 68831275
methyl 3-(hydroxymethyl)-1-methoxycyclobutane-1-carboxylate
CID 178200449
methyl 3-hydroxy-1-methoxycyclobutane-1-carboxylate
CID 137347052
trans-(3R,5R)-3,4,5-trihydroxy-1-methoxycyclohexane-1-carboxylic acid
CID 130981169
ethyl 3-iodo-1-methoxycyclobutane-1-carboxylate
CID 130422583
3-amino-N-(2,3-dihydro-1-benzofuran-3-ylmethyl)-1-methoxycyclobutane-1-carboxamide
CID 166305920
1-(1-methoxycycloheptyl)ethanone
CID 83225564
1,3,4,5-tetramethoxycyclohexane-1-carboxylic acid
CID 20695746
bis[4-(hydroxymethyl)-1-methoxycyclohexyl]methanone
CID 174821338

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-methoxycyclobutane-1-carboxamide?
The IUPAC name of 3-amino-1-methoxycyclobutane-1-carboxamide (CID 142554999) is 3-amino-1-methoxycyclobutane-1-carboxamide.
What is the SMILES notation for 3-amino-1-methoxycyclobutane-1-carboxamide?
The canonical SMILES for 3-amino-1-methoxycyclobutane-1-carboxamide is COC1(C(N)=O)CC(N)C1.
What is the InChIKey of 3-amino-1-methoxycyclobutane-1-carboxamide?
The InChIKey is ZSXCNCAFWCSTDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-10-6(5(8)9)2-4(7)3-6/h4H,2-3,7H2,1H3,(H2,8,9).
What are the key properties of 3-amino-1-methoxycyclobutane-1-carboxamide?
3-amino-1-methoxycyclobutane-1-carboxamide has a molecular weight of 144.17 g/mol, XLogP of -1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-methoxycyclobutane-1-carboxamide is sourced from PubChem (CID 142554999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).