2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide

C14H28N2O2 — CID 79586499

IUPAC2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide
SMILESCCCCOCCC1CCCC1(NCC)C(N)=O
InChIInChI=1S/C14H28N2O2/c1-3-5-10-18-11-8-12-7-6-9-14(12,13(15)17)16-4-2/h12,16H,3-11H2,1-2H3,(H2,15,17)
InChIKeyCSDKTMKMKUUIHW-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.83
Rot. Bonds9

About 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide

2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide (PubChem CID 79586499) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide
PubChem CID79586499
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide
SMILESCCCCOCCC1CCCC1(NCC)C(N)=O
InChIInChI=1S/C14H28N2O2/c1-3-5-10-18-11-8-12-7-6-9-14(12,13(15)17)16-4-2/h12,16H,3-11H2,1-2H3,(H2,15,17)
InChIKeyCSDKTMKMKUUIHW-UHFFFAOYSA-N
XLogP1.83
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.83
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-[2-(cyclohexylmethoxy)ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79587215
2-[2-(2-methoxyethoxy)ethyl]-1-(propylamino)cyclopentane-1-carboxamide
CID 79581463
1-amino-2-(2-butoxyethyl)cyclopentane-1-carboxamide
CID 79588205
2-[2-(dipropylamino)ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79576868
1-(ethylamino)-2-(2-propan-2-ylsulfanylethyl)cyclopentane-1-carboxamide
CID 79587817
2-[2-(2-cyclopropylethoxy)ethyl]-1-(methylamino)cyclopentane-1-carboxamide
CID 106204227
1-amino-2-(2-heptoxyethyl)cyclopentane-1-carboxamide
CID 79571750
2-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79564236
methyl 1-(methylamino)-2-(2-pentoxyethyl)cyclopentane-1-carboxylate
CID 79587746
2-[2-[cyclopropyl(2-methoxyethyl)amino]ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79564755
2-[2-[2,2-dimethylpropyl(methyl)amino]ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79564467
2-[2-(3,3-dimethylbutoxy)ethyl]-1-(ethylamino)cyclopentane-1-carboxylic acid
CID 79588315

Frequently Asked Questions

What is the IUPAC name of 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide?
The IUPAC name of 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide (CID 79586499) is 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide is CCCCOCCC1CCCC1(NCC)C(N)=O.
What is the InChIKey of 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide?
The InChIKey is CSDKTMKMKUUIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-3-5-10-18-11-8-12-7-6-9-14(12,13(15)17)16-4-2/h12,16H,3-11H2,1-2H3,(H2,15,17).
What are the key properties of 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide?
2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.83, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethyl)-1-(ethylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 79586499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).