5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide

C12H18N2O2 — CID 115271474

IUPAC5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide
SMILESCNCC1(CNC(=O)c2ccc(C)o2)CC1
InChIInChI=1S/C12H18N2O2/c1-9-3-4-10(16-9)11(15)14-8-12(5-6-12)7-13-2/h3-4,13H,5-8H2,1-2H3,(H,14,15)
InChIKeyRMIKKTBZKSNERX-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.32
Rot. Bonds5

About 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide

5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide (PubChem CID 115271474) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide
PubChem CID115271474
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide
SMILESCNCC1(CNC(=O)c2ccc(C)o2)CC1
InChIInChI=1S/C12H18N2O2/c1-9-3-4-10(16-9)11(15)14-8-12(5-6-12)7-13-2/h3-4,13H,5-8H2,1-2H3,(H,14,15)
InChIKeyRMIKKTBZKSNERX-UHFFFAOYSA-N
XLogP1.32
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(bromomethyl)cyclohexyl]methyl]-5-methylfuran-2-carboxamide
CID 113359960
4-bromo-N-[[1-(methylaminomethyl)cyclopropyl]methyl]benzamide
CID 115267378
N-[[1-(aminomethyl)cyclopropyl]methyl]-5-ethylfuran-2-carboxamide
CID 115456771
5-methyl-N-(2-methylpropyl)furan-2-carboxamide
CID 3644011
N-[(2R)-2-(dimethylamino)propyl]-5-methylfuran-2-carboxamide
CID 94096526
N-[(4-hydroxypyrrolidin-3-yl)methyl]-5-methylfuran-2-carboxamide;hydrochloride
CID 120948004
5-bromo-N-[[1-(methylaminomethyl)cyclopropyl]methyl]thiophene-2-carboxamide
CID 115271454
5-methyl-N-[[(1S,5R)-1,3,3-trimethyl-5-[(5-methylfuran-2-carbonyl)amino]cyclohexyl]methyl]furan-2-carboxamide
CID 40601347
(5-methylfuran-2-yl)-[2-methyl-2-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 115270641
N-(4-hydroxybutyl)-5-methylfuran-2-carboxamide
CID 106843396
N-[1-(hydroxymethyl)cyclobutyl]-5-methylfuran-2-carboxamide
CID 115877897
5-ethoxy-N-[[1-(methoxymethyl)cyclopropyl]methyl]furan-2-carboxamide
CID 122558865

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide?
The IUPAC name of 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide (CID 115271474) is 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide?
The canonical SMILES for 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide is CNCC1(CNC(=O)c2ccc(C)o2)CC1.
What is the InChIKey of 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide?
The InChIKey is RMIKKTBZKSNERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-3-4-10(16-9)11(15)14-8-12(5-6-12)7-13-2/h3-4,13H,5-8H2,1-2H3,(H,14,15).
What are the key properties of 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide?
5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]furan-2-carboxamide is sourced from PubChem (CID 115271474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).