4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine

C11H19NO3 — CID 82714632

IUPAC4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine
SMILESCOCCONC(C)CCc1ccco1
InChIInChI=1S/C11H19NO3/c1-10(12-15-9-8-13-2)5-6-11-4-3-7-14-11/h3-4,7,10,12H,5-6,8-9H2,1-2H3
InChIKeyHZMCMOKCEJQMTP-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.77
Rot. Bonds8

About 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine

4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine (PubChem CID 82714632) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine
PubChem CID82714632
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine
SMILESCOCCONC(C)CCc1ccco1
InChIInChI=1S/C11H19NO3/c1-10(12-15-9-8-13-2)5-6-11-4-3-7-14-11/h3-4,7,10,12H,5-6,8-9H2,1-2H3
InChIKeyHZMCMOKCEJQMTP-UHFFFAOYSA-N
XLogP1.77
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(furan-2-yl)butan-2-ylamino]oxyacetamide
CID 112673041
2-(2-methoxyethyl)furan
CID 19010334
N-[4-(furan-2-yl)butan-2-yl]-6-(2-methoxyethoxy)pyridin-3-amine
CID 43688437
2-[4-(furan-2-yl)butan-2-ylamino]-4-methoxybutan-1-ol
CID 114210422
4-(furan-2-yl)-N-[2-(3-methoxypropoxy)ethyl]butan-2-amine
CID 103178791
2-amino-N-[4-(furan-2-yl)butan-2-yl]-5-methoxypentanamide
CID 81088081
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
methyl 2-[4-(furan-2-yl)butan-2-ylamino]-2-methylpropanoate
CID 43726163
methyl 3-[4-(furan-2-yl)butan-2-ylamino]propanoate
CID 43478962
N-[4-(furan-2-yl)butan-2-yl]-2-methoxybenzamide
CID 18162458
ethyl N-[4-(furan-2-yl)butan-2-yl]carbamate
CID 60651451
2-[4-(furan-2-yl)butan-2-ylamino]butanoic acid
CID 64669169

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine?
The IUPAC name of 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine (CID 82714632) is 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine?
The canonical SMILES for 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine is COCCONC(C)CCc1ccco1.
What is the InChIKey of 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine?
The InChIKey is HZMCMOKCEJQMTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-10(12-15-9-8-13-2)5-6-11-4-3-7-14-11/h3-4,7,10,12H,5-6,8-9H2,1-2H3.
What are the key properties of 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine?
4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine has a molecular weight of 213.28 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-N-(2-methoxyethoxy)butan-2-amine is sourced from PubChem (CID 82714632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).