2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide

C15H30N2O2 — CID 119786683

IUPAC2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NCCOC1CCCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-10-15(2,16)14(18)17-11-12-19-13-8-6-4-5-7-9-13/h13H,3-12,16H2,1-2H3,(H,17,18)
InChIKeyDEPFYQJTPHYFSZ-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.36
Rot. Bonds7

About 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide

2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide (PubChem CID 119786683) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide
PubChem CID119786683
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NCCOC1CCCCCC1
InChIInChI=1S/C15H30N2O2/c1-3-10-15(2,16)14(18)17-11-12-19-13-8-6-4-5-7-9-13/h13H,3-12,16H2,1-2H3,(H,17,18)
InChIKeyDEPFYQJTPHYFSZ-UHFFFAOYSA-N
XLogP2.36
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.36
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

N-(2-cyclohexyloxyethyl)-2,2-dimethylpropanamide
CID 61149982
N-(2-cyclohexyloxyethyl)-2-methoxy-2-methylpropanamide
CID 113233400
N-(2-cyclopentyloxyethyl)-2-(ethylamino)-2-methylpropanamide
CID 55261847
2-amino-N-(cyclooctylmethyl)-2-methylpentanamide;hydrochloride
CID 119741898
N-(2-cyclohexyloxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80547271
2-amino-N-(2-methoxyethyl)-2-methylpentanamide
CID 60848561
2-amino-N-(3-ethoxypropyl)-2-methylpentanamide
CID 60848573
(2R)-2-amino-N-(2-cyclohexyloxyethyl)pentanamide
CID 98582827
2-amino-N-(2-cyclopentyloxyethyl)-3,3-dimethylbutanamide
CID 77009240
2-amino-N-(2-hydroxyethyl)-2-methylpentanamide
CID 60847863
2-amino-N-(2-cyclopentyloxyethyl)pentanamide
CID 63827048
2-amino-N-[2-(azepan-1-yl)ethyl]-2-methylpentanamide
CID 61240400

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide (CID 119786683) is 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide is CCCC(C)(N)C(=O)NCCOC1CCCCCC1.
What is the InChIKey of 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide?
The InChIKey is DEPFYQJTPHYFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-3-10-15(2,16)14(18)17-11-12-19-13-8-6-4-5-7-9-13/h13H,3-12,16H2,1-2H3,(H,17,18).
What are the key properties of 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide?
2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide has a molecular weight of 270.42 g/mol, XLogP of 2.36, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cycloheptyloxyethyl)-2-methylpentanamide is sourced from PubChem (CID 119786683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).