2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride

C15H29ClN2O2 — CID 119803524

IUPAC2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC1CC(OCC)C12CCC2.Cl
InChIInChI=1S/C15H28N2O2.ClH/c1-4-7-14(3,16)13(18)17-11-10-12(19-5-2)15(11)8-6-9-15;/h11-12H,4-10,16H2,1-3H3,(H,17,18);1H
InChIKeyFIFBFVFENNTYAM-UHFFFAOYSA-N
MW304.86 g/mol
LogP2.39
Rot. Bonds6

About 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride

2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride (PubChem CID 119803524) has the molecular formula C15H29ClN2O2 and a molecular weight of 304.86 g/mol. Its IUPAC name is 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride
PubChem CID119803524
Molecular FormulaC15H29ClN2O2
Molecular Weight304.86 g/mol
Exact Mass304.19
IUPAC Name2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NC1CC(OCC)C12CCC2.Cl
InChIInChI=1S/C15H28N2O2.ClH/c1-4-7-14(3,16)13(18)17-11-10-12(19-5-2)15(11)8-6-9-15;/h11-12H,4-10,16H2,1-3H3,(H,17,18);1H
InChIKeyFIFBFVFENNTYAM-UHFFFAOYSA-N
XLogP2.39
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.86
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride (CID 119803524) is 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)NC1CC(OCC)C12CCC2.Cl.
What is the InChIKey of 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride?
The InChIKey is FIFBFVFENNTYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2.ClH/c1-4-7-14(3,16)13(18)17-11-10-12(19-5-2)15(11)8-6-9-15;/h11-12H,4-10,16H2,1-3H3,(H,17,18);1H.
What are the key properties of 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride?
2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride has a molecular weight of 304.86 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119803524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).