2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine

C14H24N2O — CID 80996990

IUPAC2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine
SMILESCCNCC1CCC1N(C)Cc1ccoc1C
InChIInChI=1S/C14H24N2O/c1-4-15-9-12-5-6-14(12)16(3)10-13-7-8-17-11(13)2/h7-8,12,14-15H,4-6,9-10H2,1-3H3
InChIKeyJCLKXEFRZMJAJF-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.41
Rot. Bonds6

About 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine

2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine (PubChem CID 80996990) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine
PubChem CID80996990
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine
SMILESCCNCC1CCC1N(C)Cc1ccoc1C
InChIInChI=1S/C14H24N2O/c1-4-15-9-12-5-6-14(12)16(3)10-13-7-8-17-11(13)2/h7-8,12,14-15H,4-6,9-10H2,1-3H3
InChIKeyJCLKXEFRZMJAJF-UHFFFAOYSA-N
XLogP2.41
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(tert-butylamino)methyl]-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine
CID 80996883
trans-(1S,2S)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 102731964
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclohexan-1-ol
CID 61426304
2-(ethylaminomethyl)-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclobutan-1-amine
CID 80998760
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]cyclopentane-1-carbonitrile
CID 55137173
N,2,2-triethyl-N'-methyl-N'-[(2-methylfuran-3-yl)methyl]propane-1,3-diamine
CID 62260916
1-N-ethyl-4-N-methyl-4-N-[(2-methylfuran-3-yl)methyl]pentane-1,4-diamine
CID 62411483
N-(furan-2-ylmethyl)-N-methyl-2-(propylaminomethyl)cyclobutan-1-amine
CID 80998378
2-(ethylaminomethyl)-N-methyl-N-(2-methylpropyl)cyclobutan-1-amine
CID 80999159
N-methyl-N-[(2-methylfuran-3-yl)methyl]hydroxylamine
CID 96732982
3-N-methyl-3-N-[(2-methylfuran-3-yl)methyl]cyclopentane-1,3-diamine
CID 79469279
N-ethyl-2,2-dimethyl-5-[[methyl-[(2-methylfuran-3-yl)methyl]amino]methyl]cyclopentan-1-amine
CID 79856167

Frequently Asked Questions

What is the IUPAC name of 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine?
The IUPAC name of 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine (CID 80996990) is 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine.
What is the SMILES notation for 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine?
The canonical SMILES for 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine is CCNCC1CCC1N(C)Cc1ccoc1C.
What is the InChIKey of 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine?
The InChIKey is JCLKXEFRZMJAJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-15-9-12-5-6-14(12)16(3)10-13-7-8-17-11(13)2/h7-8,12,14-15H,4-6,9-10H2,1-3H3.
What are the key properties of 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine?
2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]cyclobutan-1-amine is sourced from PubChem (CID 80996990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).