2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide

C9H14N2O2 — CID 61370638

IUPAC2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
SMILESCc1occc1CN(C)CC(N)=O
InChIInChI=1S/C9H14N2O2/c1-7-8(3-4-13-7)5-11(2)6-9(10)12/h3-4H,5-6H2,1-2H3,(H2,10,12)
InChIKeySMWBQXDWLAGZBJ-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.51
Rot. Bonds4

About 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide

2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide (PubChem CID 61370638) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
PubChem CID61370638
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
SMILESCc1occc1CN(C)CC(N)=O
InChIInChI=1S/C9H14N2O2/c1-7-8(3-4-13-7)5-11(2)6-9(10)12/h3-4H,5-6H2,1-2H3,(H2,10,12)
InChIKeySMWBQXDWLAGZBJ-UHFFFAOYSA-N
XLogP0.51
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanehydrazide
CID 63578941
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]-1-phenylethanone
CID 62036219
3-methyl-4-[methyl-[(2-methylfuran-3-yl)methyl]amino]but-2-enoic acid
CID 77006372
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
CID 61371044
N-methyl-N-[(2-methylfuran-3-yl)methyl]hydroxylamine
CID 96732982
4-amino-3-[methyl-[(2-methylfuran-3-yl)methyl]amino]butanamide
CID 66426470
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]-1-thiophen-2-ylethanone
CID 62037588
2-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]furan-3-carbohydrazide
CID 63579482
ethane;2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 142212202
2-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]propanamide
CID 61426214
N-(5-amino-2-methylphenyl)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61426561
3-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]pentan-3-ol
CID 115919434

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide?
The IUPAC name of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide (CID 61370638) is 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide is Cc1occc1CN(C)CC(N)=O.
What is the InChIKey of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide?
The InChIKey is SMWBQXDWLAGZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7-8(3-4-13-7)5-11(2)6-9(10)12/h3-4H,5-6H2,1-2H3,(H2,10,12).
What are the key properties of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide?
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide has a molecular weight of 182.22 g/mol, XLogP of 0.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide is sourced from PubChem (CID 61370638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).