N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine

C17H26N2O2 — CID 62461132

IUPACN-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
SMILESCc1cc(CN(C)Cc2ccoc2)oc1CNC(C)(C)C
InChIInChI=1S/C17H26N2O2/c1-13-8-15(21-16(13)9-18-17(2,3)4)11-19(5)10-14-6-7-20-12-14/h6-8,12,18H,9-11H2,1-5H3
InChIKeyZWEXWTQVLXFSEZ-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.70
Rot. Bonds6

About N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine

N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62461132) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID62461132
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
SMILESCc1cc(CN(C)Cc2ccoc2)oc1CNC(C)(C)C
InChIInChI=1S/C17H26N2O2/c1-13-8-15(21-16(13)9-18-17(2,3)4)11-19(5)10-14-6-7-20-12-14/h6-8,12,18H,9-11H2,1-5H3
InChIKeyZWEXWTQVLXFSEZ-UHFFFAOYSA-N
XLogP3.70
TPSA41.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine with MolForge

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Related Compounds

N-[[5-[(tert-butylamino)methyl]-4-methylfuran-2-yl]methyl]-N-methylaniline
CID 62438515
N-[[5-[[cyclopentylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 63657143
4-[(tert-butylamino)methyl]-N-(furan-3-ylmethyl)-N,2-dimethylaniline
CID 62121037
2-methyl-N-[[3-methyl-5-[[methyl(oxolan-2-ylmethyl)amino]methyl]furan-2-yl]methyl]propan-2-amine
CID 62436432
N-tert-butyl-N'-(furan-3-ylmethyl)-N'-methylbutane-1,4-diamine
CID 55072235
5-[[furan-3-ylmethyl(methyl)amino]methyl]-2-methylaniline
CID 61422466
1-[5-[[furan-3-ylmethyl(methyl)amino]methyl]furan-3-yl]-N-methylmethanamine
CID 62462911
5-[(tert-butylamino)methyl]-N-(furan-3-ylmethyl)-N,2-dimethylpyridin-4-amine
CID 81249115
N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]furan-3-yl]methyl]propan-1-amine
CID 55072380
N-[[4-[[furan-3-ylmethyl(methyl)amino]methyl]-5-methylfuran-2-yl]methyl]ethanamine
CID 55072431
2-methyl-N-[[3-methyl-5-(1,2,4-triazol-1-ylmethyl)furan-2-yl]methyl]propan-2-amine
CID 55072838
N-butyl-N-[[5-[(tert-butylamino)methyl]-4-methylfuran-2-yl]methyl]cyclopropanamine
CID 62428779

Frequently Asked Questions

What is the IUPAC name of N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine (CID 62461132) is N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine is Cc1cc(CN(C)Cc2ccoc2)oc1CNC(C)(C)C.
What is the InChIKey of N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is ZWEXWTQVLXFSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-8-15(21-16(13)9-18-17(2,3)4)11-19(5)10-14-6-7-20-12-14/h6-8,12,18H,9-11H2,1-5H3.
What are the key properties of N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine?
N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 290.41 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[[furan-3-ylmethyl(methyl)amino]methyl]-3-methylfuran-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62461132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).