N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide

C16H24N2O3 — CID 115666757

IUPACN-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide
SMILESCCOc1ccccc1OCCNCCNC(=O)C1CC1
InChIInChI=1S/C16H24N2O3/c1-2-20-14-5-3-4-6-15(14)21-12-11-17-9-10-18-16(19)13-7-8-13/h3-6,13,17H,2,7-12H2,1H3,(H,18,19)
InChIKeyLNXGLJUZTNSZDH-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.58
Rot. Bonds10

About N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide

N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide (PubChem CID 115666757) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide
PubChem CID115666757
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide
SMILESCCOc1ccccc1OCCNCCNC(=O)C1CC1
InChIInChI=1S/C16H24N2O3/c1-2-20-14-5-3-4-6-15(14)21-12-11-17-9-10-18-16(19)13-7-8-13/h3-6,13,17H,2,7-12H2,1H3,(H,18,19)
InChIKeyLNXGLJUZTNSZDH-UHFFFAOYSA-N
XLogP1.58
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(3-ethoxy-2-hydroxyphenyl)methylamino]ethyl]cyclopropanecarboxamide
CID 115602924
N-[2-(2-methylphenoxy)ethyl]cyclobutanecarboxamide
CID 113099100
4-[[2-(2-ethoxyphenoxy)ethylamino]methyl]cyclohexan-1-ol
CID 106133459
N-[2-(2-ethoxyphenoxy)ethyl]pentan-1-amine
CID 62572725
N-[2-[[2-(2-methylphenoxy)acetyl]amino]ethyl]cyclopropanecarboxamide
CID 47102199
N-[2-(2-methoxy-4-methylphenoxy)ethyl]cyclopropanecarboxamide
CID 113101778
N-[2-(cyclopropanecarbonylamino)ethyl]-3-ethoxy-4-methoxybenzamide
CID 51153110
N-[[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]methyl]cyclopropanecarboxamide
CID 16969834
2-(2-ethoxyphenoxy)-N-(oxolan-3-ylmethyl)ethanamine
CID 62571173
N-[2-(2-aminophenoxy)ethyl]oxane-4-carboxamide
CID 62907038
3-amino-N-[2-(2-methylphenoxy)ethyl]cyclopentane-1-carboxamide
CID 119742919
N-[2-(2-methoxyphenoxy)ethyl]cyclohex-3-ene-1-carboxamide
CID 43009468

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide (CID 115666757) is N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide is CCOc1ccccc1OCCNCCNC(=O)C1CC1.
What is the InChIKey of N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide?
The InChIKey is LNXGLJUZTNSZDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-20-14-5-3-4-6-15(14)21-12-11-17-9-10-18-16(19)13-7-8-13/h3-6,13,17H,2,7-12H2,1H3,(H,18,19).
What are the key properties of N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide?
N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.58, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-ethoxyphenoxy)ethylamino]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 115666757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).