1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide

C15H30N2O2 — CID 79571750

IUPAC1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide
SMILESCCCCCCCOCCC1CCCC1(N)C(N)=O
InChIInChI=1S/C15H30N2O2/c1-2-3-4-5-6-11-19-12-9-13-8-7-10-15(13,17)14(16)18/h13H,2-12,17H2,1H3,(H2,16,18)
InChIKeyWUWQYKMARZMVPF-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.35
Rot. Bonds10

About 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide

1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide (PubChem CID 79571750) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide
PubChem CID79571750
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide
SMILESCCCCCCCOCCC1CCCC1(N)C(N)=O
InChIInChI=1S/C15H30N2O2/c1-2-3-4-5-6-11-19-12-9-13-8-7-10-15(13,17)14(16)18/h13H,2-12,17H2,1H3,(H2,16,18)
InChIKeyWUWQYKMARZMVPF-UHFFFAOYSA-N
XLogP2.35
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.35
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

1-amino-2-(2-butoxyethyl)cyclopentane-1-carboxamide
CID 79588205
1-amino-2-(2-octoxyethyl)cyclopentane-1-carboxylic acid
CID 79571531
1-amino-2-[2-(2-propoxyethoxy)ethyl]cyclopentane-1-carboxamide
CID 79588401
1-amino-2-[2-(2-butoxyethoxy)ethyl]cyclopentane-1-carboxylic acid
CID 79571683
1-amino-2-(2-butylsulfanylethyl)cyclopentane-1-carboxamide
CID 79587862
2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79586499
1-amino-2-(2-propan-2-yloxyethyl)cyclopentane-1-carboxamide
CID 79581080
1-amino-2-(2-butan-2-yloxyethyl)cyclopentane-1-carboxamide
CID 79586651
ethyl 1-amino-2-[2-(2-ethoxyethoxy)ethyl]cyclopentane-1-carboxylate
CID 79581836
1-amino-2-[2-[methyl(propan-2-yl)amino]ethyl]cyclopentane-1-carboxamide
CID 79577891
methyl 1-(methylamino)-2-(2-pentoxyethyl)cyclopentane-1-carboxylate
CID 79587746
2-[2-(2-methoxyethoxy)ethyl]-1-(propylamino)cyclopentane-1-carboxamide
CID 79581463

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide (CID 79571750) is 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide is CCCCCCCOCCC1CCCC1(N)C(N)=O.
What is the InChIKey of 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide?
The InChIKey is WUWQYKMARZMVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-2-3-4-5-6-11-19-12-9-13-8-7-10-15(13,17)14(16)18/h13H,2-12,17H2,1H3,(H2,16,18).
What are the key properties of 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide?
1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide has a molecular weight of 270.42 g/mol, XLogP of 2.35, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 79571750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).