2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride

C15H31ClN2O2 — CID 119820346

IUPAC2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCC1(CCOCC)CCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-7-14(3,16)13(18)17-12-15(8-6-9-15)10-11-19-5-2;/h4-12,16H2,1-3H3,(H,17,18);1H
InChIKeyJFAVATVZWOLDOL-UHFFFAOYSA-N
MW306.88 g/mol
LogP2.64
Rot. Bonds9

About 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride

2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride (PubChem CID 119820346) has the molecular formula C15H31ClN2O2 and a molecular weight of 306.88 g/mol. Its IUPAC name is 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride
PubChem CID119820346
Molecular FormulaC15H31ClN2O2
Molecular Weight306.88 g/mol
Exact Mass306.21
IUPAC Name2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCC1(CCOCC)CCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-7-14(3,16)13(18)17-12-15(8-6-9-15)10-11-19-5-2;/h4-12,16H2,1-3H3,(H,17,18);1H
InChIKeyJFAVATVZWOLDOL-UHFFFAOYSA-N
XLogP2.64
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.88
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[[1-(2-hydroxyethyl)cyclopentyl]methyl]-2-methylpentanamide
CID 119817843
1-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]cyclopropane-1-carboxamide
CID 119820293
(2S)-2-amino-N-[[1-(2-ethoxyethyl)cyclopentyl]methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119812179
1-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]cyclohexane-1-carboxamide
CID 119344511
1-[[(2-amino-2-methylpentanoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 113311179
2-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-2-methylpropanamide
CID 119344523
2-amino-N-(3-ethoxypropyl)-2-methylpentanamide
CID 60848573
3-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]butanamide;hydrochloride
CID 119820336
N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119820344
(2S)-2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-4-methylpentanamide;hydrochloride
CID 119820348
2-(cyclopropylmethylamino)-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]acetamide;hydrochloride
CID 119820320
N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119820324

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride (CID 119820346) is 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)NCC1(CCOCC)CCC1.Cl.
What is the InChIKey of 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride?
The InChIKey is JFAVATVZWOLDOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.ClH/c1-4-7-14(3,16)13(18)17-12-15(8-6-9-15)10-11-19-5-2;/h4-12,16H2,1-3H3,(H,17,18);1H.
What are the key properties of 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride?
2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride has a molecular weight of 306.88 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119820346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).