N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine

C11H23NO — CID 106457012

IUPACN-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
SMILESCCCOCCC1(CNCC)CC1
InChIInChI=1S/C11H23NO/c1-3-8-13-9-7-11(5-6-11)10-12-4-2/h12H,3-10H2,1-2H3
InChIKeyFSFHJERAUCBIMC-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.19
Rot. Bonds8

About N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine

N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine (PubChem CID 106457012) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
PubChem CID106457012
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine
SMILESCCCOCCC1(CNCC)CC1
InChIInChI=1S/C11H23NO/c1-3-8-13-9-7-11(5-6-11)10-12-4-2/h12H,3-10H2,1-2H3
InChIKeyFSFHJERAUCBIMC-UHFFFAOYSA-N
XLogP2.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.19
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-[[1-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566642
N-[[1-(2-propoxyethyl)cyclobutyl]methyl]propan-2-amine
CID 106456993
N-[[3-(2-butoxyethyl)oxan-3-yl]methyl]ethanamine
CID 55149572
N-[[1-(chloromethyl)cyclopropyl]methyl]-2-propoxyethanamine
CID 106457795
N-[[4-tert-butyl-1-(2-ethoxyethyl)cyclohexyl]methyl]ethanamine
CID 62724223
N-[(1-octylcyclobutyl)methyl]ethanamine
CID 65194537
N-[[1-(2-butoxyethyl)cyclopentyl]methyl]propan-1-amine
CID 55106499
N-[[1-(2-phenoxyethyl)cyclopropyl]methyl]ethanamine
CID 66023995
1-(chloromethyl)-1-(2-propoxyethyl)cyclopentane
CID 106459535
2-methoxy-N-[[1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclobutyl]methyl]ethanamine
CID 104566649
N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclohexyl]methyl]ethanamine
CID 112591476
N-[[1-(3-methylbutyl)cyclopropyl]methyl]ethanamine
CID 66026435

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine (CID 106457012) is N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine is CCCOCCC1(CNCC)CC1.
What is the InChIKey of N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine?
The InChIKey is FSFHJERAUCBIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-8-13-9-7-11(5-6-11)10-12-4-2/h12H,3-10H2,1-2H3.
What are the key properties of N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine?
N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine has a molecular weight of 185.31 g/mol, XLogP of 2.19, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-propoxyethyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 106457012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).