N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine

C12H21NO2 — CID 61483217

IUPACN-(2-butoxyethyl)-2-(furan-2-yl)ethanamine
SMILESCCCCOCCNCCc1ccco1
InChIInChI=1S/C12H21NO2/c1-2-3-9-14-11-8-13-7-6-12-5-4-10-15-12/h4-5,10,13H,2-3,6-9,11H2,1H3
InChIKeyMUIHYPYWBSDHPC-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.23
Rot. Bonds9

About N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine

N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine (PubChem CID 61483217) has the molecular formula C12H21NO2 and a molecular weight of 211.31 g/mol. Its IUPAC name is N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound NameN-(2-butoxyethyl)-2-(furan-2-yl)ethanamine
PubChem CID61483217
Molecular FormulaC12H21NO2
Molecular Weight211.31 g/mol
Exact Mass211.16
IUPAC NameN-(2-butoxyethyl)-2-(furan-2-yl)ethanamine
SMILESCCCCOCCNCCc1ccco1
InChIInChI=1S/C12H21NO2/c1-2-3-9-14-11-8-13-7-6-12-5-4-10-15-12/h4-5,10,13H,2-3,6-9,11H2,1H3
InChIKeyMUIHYPYWBSDHPC-UHFFFAOYSA-N
XLogP2.23
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-butoxyethyl)-N'-cyclopropyl-N'-(furan-2-ylmethyl)ethane-1,2-diamine
CID 62558803
3-ethoxy-N-[2-(furan-2-ylmethoxy)ethyl]propan-1-amine
CID 62565573
2-[2-(2-butoxyethoxy)ethyl]-1-ethyl-3-[2-(furan-2-yl)ethyl]guanidine
CID 111499619
1-(3-butoxypropyl)-3-[2-(furan-2-yl)ethyl]-2-propylguanidine;hydroiodide
CID 111769874
5-(furan-2-ylmethoxy)-N-propylpentan-1-amine
CID 62445042
N-(3-butoxypropyl)-2-(furan-2-yl)acetamide
CID 110484658
N-[2-(furan-2-yl)ethyl]-2,2-dimethoxyethanamine
CID 63684806
N-[2-(furan-2-ylmethoxy)ethyl]-2-methoxyethanamine
CID 62565000
4-(furan-2-yl)-N-[2-(3-methoxypropoxy)ethyl]butan-2-amine
CID 103178791
1-(3-butoxypropyl)-3-[2-(furan-2-yl)ethyl]-2-[(4-methoxyphenyl)methyl]guanidine;hydroiodide
CID 111769882
N-(2-butoxyethyl)-2-(5-chlorothiophen-2-yl)ethanamine
CID 106046388
1-(3-ethoxypropyl)-3-[2-(furan-2-yl)ethyl]thiourea
CID 113218414

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine?
The IUPAC name of N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine (CID 61483217) is N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine is CCCCOCCNCCc1ccco1.
What is the InChIKey of N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine?
The InChIKey is MUIHYPYWBSDHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-2-3-9-14-11-8-13-7-6-12-5-4-10-15-12/h4-5,10,13H,2-3,6-9,11H2,1H3.
What are the key properties of N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine?
N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine has a molecular weight of 211.31 g/mol, XLogP of 2.23, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyethyl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 61483217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).