N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine

C16H26N4O — CID 43758895

IUPACN'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCN(C)CC(C)(C)CNC(c1ccco1)c1nccn1C
InChIInChI=1S/C16H26N4O/c1-16(2,12-19(3)4)11-18-14(13-7-6-10-21-13)15-17-8-9-20(15)5/h6-10,14,18H,11-12H2,1-5H3
InChIKeyOVXBOODLKDYJBH-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.28
Rot. Bonds7

About N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine

N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine (PubChem CID 43758895) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine
PubChem CID43758895
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCN(C)CC(C)(C)CNC(c1ccco1)c1nccn1C
InChIInChI=1S/C16H26N4O/c1-16(2,12-19(3)4)11-18-14(13-7-6-10-21-13)15-17-8-9-20(15)5/h6-10,14,18H,11-12H2,1-5H3
InChIKeyOVXBOODLKDYJBH-UHFFFAOYSA-N
XLogP2.28
TPSA46.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine with MolForge

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Related Compounds

1-[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]-4,4-dimethylpentan-2-ol
CID 107151567
N-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-2-propan-2-yloxyethanamine
CID 104759298
3-[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]propan-1-ol
CID 43770586
N-ethyl-2-[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]-N-methylacetamide
CID 107856099
1-(furan-2-yl)-1-(1-methylimidazol-2-yl)-N-(1,3-thiazol-2-ylmethyl)methanamine
CID 61284438
2-[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]acetamide
CID 43754710
N-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-2-(trifluoromethylsulfanyl)ethanamine
CID 106427266
N-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-2-methylsulfonylethanamine
CID 54931888
1-(furan-2-yl)-1-(1-methylimidazol-2-yl)-N-[(2-methylphenyl)methyl]methanamine
CID 60913950
6-[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]hexan-1-ol
CID 107849626
N-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-3-methylsulfonylpropan-1-amine
CID 61020764
[1-[[[furan-2-yl-(1-methylimidazol-2-yl)methyl]amino]methyl]cyclopropyl]methanol
CID 115454330

Frequently Asked Questions

What is the IUPAC name of N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine (CID 43758895) is N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine is CN(C)CC(C)(C)CNC(c1ccco1)c1nccn1C.
What is the InChIKey of N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The InChIKey is OVXBOODLKDYJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-16(2,12-19(3)4)11-18-14(13-7-6-10-21-13)15-17-8-9-20(15)5/h6-10,14,18H,11-12H2,1-5H3.
What are the key properties of N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine has a molecular weight of 290.41 g/mol, XLogP of 2.28, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[furan-2-yl-(1-methylimidazol-2-yl)methyl]-N,N,2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 43758895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).