1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol

C11H19NO2 — CID 61423764

IUPAC1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol
SMILESCCC(O)CN(CC)Cc1ccco1
InChIInChI=1S/C11H19NO2/c1-3-10(13)8-12(4-2)9-11-6-5-7-14-11/h5-7,10,13H,3-4,8-9H2,1-2H3
InChIKeyKZVRHZJMWFLAIY-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.87
Rot. Bonds6

About 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol

1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol (PubChem CID 61423764) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol.

Molecular Properties

Compound Name1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol
PubChem CID61423764
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol
SMILESCCC(O)CN(CC)Cc1ccco1
InChIInChI=1S/C11H19NO2/c1-3-10(13)8-12(4-2)9-11-6-5-7-14-11/h5-7,10,13H,3-4,8-9H2,1-2H3
InChIKeyKZVRHZJMWFLAIY-UHFFFAOYSA-N
XLogP1.87
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol 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

1-bromo-3-[ethyl(furan-2-ylmethyl)amino]propan-2-ol
CID 112561353
1-[ethyl(furan-2-ylmethyl)amino]-3-(propan-2-ylamino)propan-2-ol
CID 61423306
2,2-diethoxy-N-ethyl-N-(furan-2-ylmethyl)ethanamine
CID 63619200
3-[ethyl(furan-2-ylmethyl)amino]-2-methylpropanenitrile
CID 61423405
1-[furan-2-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]pentan-2-ol
CID 24713749
1-[ethyl(furan-2-ylmethyl)amino]-3-methylbutan-2-one
CID 79395471
2-ethoxy-N'-ethyl-N'-(furan-2-ylmethyl)propane-1,3-diamine
CID 63069854
1-[furan-2-ylmethyl-[(1-methyl-5-phenoxy-3-phenylpyrazol-4-yl)methyl]amino]butan-2-ol
CID 46026618
(2S)-1-[furan-2-ylmethyl(2-methylpropyl)amino]-3-(2-methylpropoxy)propan-2-ol
CID 93161246
N-ethyl-N-(furan-2-ylmethyl)prop-2-yn-1-amine
CID 60970119
(2S)-1-[furan-2-ylmethyl(3-methoxypropyl)amino]pentan-2-ol
CID 93161280
N'-ethyl-N,N'-bis(furan-2-ylmethyl)ethane-1,2-diamine
CID 62558930

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol?
The IUPAC name of 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol (CID 61423764) is 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol.
What is the SMILES notation for 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol?
The canonical SMILES for 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol is CCC(O)CN(CC)Cc1ccco1.
What is the InChIKey of 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol?
The InChIKey is KZVRHZJMWFLAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-10(13)8-12(4-2)9-11-6-5-7-14-11/h5-7,10,13H,3-4,8-9H2,1-2H3.
What are the key properties of 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol?
1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol has a molecular weight of 197.28 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(furan-2-ylmethyl)amino]butan-2-ol is sourced from PubChem (CID 61423764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).