3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide

C15H28N2O2 — CID 64891907

IUPAC3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide
SMILESCC(C)(C)C1CCCCC1NC(=O)C1(N)CCOC1
InChIInChI=1S/C15H28N2O2/c1-14(2,3)11-6-4-5-7-12(11)17-13(18)15(16)8-9-19-10-15/h11-12H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyAOTSZSLZRBUNOL-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.83
Rot. Bonds2

About 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide

3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide (PubChem CID 64891907) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide
PubChem CID64891907
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide
SMILESCC(C)(C)C1CCCCC1NC(=O)C1(N)CCOC1
InChIInChI=1S/C15H28N2O2/c1-14(2,3)11-6-4-5-7-12(11)17-13(18)15(16)8-9-19-10-15/h11-12H,4-10,16H2,1-3H3,(H,17,18)
InChIKeyAOTSZSLZRBUNOL-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide (CID 64891907) is 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide is CC(C)(C)C1CCCCC1NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide?
The InChIKey is AOTSZSLZRBUNOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-14(2,3)11-6-4-5-7-12(11)17-13(18)15(16)8-9-19-10-15/h11-12H,4-10,16H2,1-3H3,(H,17,18).
What are the key properties of 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide?
3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-tert-butylcyclohexyl)oxolane-3-carboxamide is sourced from PubChem (CID 64891907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).