3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide

C8H14N2O2 — CID 89230347

IUPAC3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide
SMILESC=C(C)NC(=O)C1(O)CC(N)C1
InChIInChI=1S/C8H14N2O2/c1-5(2)10-7(11)8(12)3-6(9)4-8/h6,12H,1,3-4,9H2,2H3,(H,10,11)
InChIKeyLRXIDSWZMMBEJI-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.51
Rot. Bonds2

About 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide

3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide (PubChem CID 89230347) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide
PubChem CID89230347
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide
SMILESC=C(C)NC(=O)C1(O)CC(N)C1
InChIInChI=1S/C8H14N2O2/c1-5(2)10-7(11)8(12)3-6(9)4-8/h6,12H,1,3-4,9H2,2H3,(H,10,11)
InChIKeyLRXIDSWZMMBEJI-UHFFFAOYSA-N
XLogP-0.51
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.51
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-prop-1-en-2-ylcyclobutane-1-carboxamide?
The IUPAC name of 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide (CID 89230347) is 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide.
What is the SMILES notation for 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide?
The canonical SMILES for 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide is C=C(C)NC(=O)C1(O)CC(N)C1.
What is the InChIKey of 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide?
The InChIKey is LRXIDSWZMMBEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-5(2)10-7(11)8(12)3-6(9)4-8/h6,12H,1,3-4,9H2,2H3,(H,10,11).
What are the key properties of 3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide?
3-amino-1-hydroxy-N-prop-1-en-2-ylcyclobutane-1-carboxamide has a molecular weight of 170.21 g/mol, XLogP of -0.51, 2 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-prop-1-en-2-ylcyclobutane-1-carboxamide is sourced from PubChem (CID 89230347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).