N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine

C8H14F3NO — CID 106212436

IUPACN-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCOCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C8H14F3NO/c1-2-13-6-5-12-7(3-4-7)8(9,10)11/h12H,2-6H2,1H3
InChIKeyNLSJCQAOIWOVHA-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.71
Rot. Bonds5

About N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine

N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine (PubChem CID 106212436) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine
PubChem CID106212436
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC NameN-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCOCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C8H14F3NO/c1-2-13-6-5-12-7(3-4-7)8(9,10)11/h12H,2-6H2,1H3
InChIKeyNLSJCQAOIWOVHA-UHFFFAOYSA-N
XLogP1.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine
CID 106212400
N-decyl-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210328
N-propyl-N'-[1-(trifluoromethyl)cyclopropyl]ethane-1,2-diamine
CID 106219094
N-(2-methoxyethyl)-N'-[1-(trifluoromethyl)cyclopropyl]ethane-1,2-diamine
CID 106219170
N-propyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 66206814
3-[[1-(trifluoromethyl)cyclopropyl]amino]propan-1-ol
CID 106212158
1-methyl-N-propyl-4-(trifluoromethyl)piperidin-4-amine
CID 66205990
2,2-dimethyl-4-[[1-(trifluoromethyl)cyclopropyl]amino]butanenitrile
CID 106212446
N-ethyl-1-(trifluoromethyl)cycloheptan-1-amine
CID 66206789
N-ethyl-N-methyl-2-[[1-(trifluoromethyl)cyclopropyl]amino]acetamide
CID 106212509
[1-(2-ethoxyethylamino)cyclohexyl]methanol
CID 62521886
5-[[1-(trifluoromethyl)cyclopropyl]amino]pentanoic acid
CID 106215305

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The IUPAC name of N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine (CID 106212436) is N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The canonical SMILES for N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine is CCOCCNC1(C(F)(F)F)CC1.
What is the InChIKey of N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
The InChIKey is NLSJCQAOIWOVHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-2-13-6-5-12-7(3-4-7)8(9,10)11/h12H,2-6H2,1H3.
What are the key properties of N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine?
N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine has a molecular weight of 197.20 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine is sourced from PubChem (CID 106212436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).