3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide

C6H12N2O2 — CID 145491551

IUPAC3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide
SMILESCNC(=O)C1(O)CC(N)C1
InChIInChI=1S/C6H12N2O2/c1-8-5(9)6(10)2-4(7)3-6/h4,10H,2-3,7H2,1H3,(H,8,9)
InChIKeyBCXDRCDORPKCDQ-UHFFFAOYSA-N
MW144.17 g/mol
LogP-1.42
Rot. Bonds1

About 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide

3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide (PubChem CID 145491551) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide
PubChem CID145491551
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide
SMILESCNC(=O)C1(O)CC(N)C1
InChIInChI=1S/C6H12N2O2/c1-8-5(9)6(10)2-4(7)3-6/h4,10H,2-3,7H2,1H3,(H,8,9)
InChIKeyBCXDRCDORPKCDQ-UHFFFAOYSA-N
XLogP-1.42
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-1.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide?
The IUPAC name of 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide (CID 145491551) is 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide.
What is the SMILES notation for 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide?
The canonical SMILES for 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide is CNC(=O)C1(O)CC(N)C1.
What is the InChIKey of 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide?
The InChIKey is BCXDRCDORPKCDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-8-5(9)6(10)2-4(7)3-6/h4,10H,2-3,7H2,1H3,(H,8,9).
What are the key properties of 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide?
3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide has a molecular weight of 144.17 g/mol, XLogP of -1.42, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-hydroxy-N-methylcyclobutane-1-carboxamide is sourced from PubChem (CID 145491551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).