N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine

C14H24N2O — CID 54793664

IUPACN-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine
SMILESCCNCC1CCN(Cc2ccc(C)o2)CC1
InChIInChI=1S/C14H24N2O/c1-3-15-10-13-6-8-16(9-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3
InChIKeyFAXCDJZBVSNOFA-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.41
Rot. Bonds5

About N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine

N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine (PubChem CID 54793664) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine
PubChem CID54793664
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine
SMILESCCNCC1CCN(Cc2ccc(C)o2)CC1
InChIInChI=1S/C14H24N2O/c1-3-15-10-13-6-8-16(9-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3
InChIKeyFAXCDJZBVSNOFA-UHFFFAOYSA-N
XLogP2.41
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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

Analyze N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine with MolForge

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Related Compounds

3-[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]propanoic acid
CID 62218058
1-[(5-methylfuran-2-yl)methyl]-N-propylpiperidin-4-amine
CID 62524387
5-cyclopropyl-N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]-1,3,4-oxadiazol-2-amine
CID 72854386
N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]-2-propyl-1,3-thiazole-4-carboxamide
CID 72867403
N-methyl-1-[(5-methylfuran-2-yl)methyl]pyrrolidin-3-amine
CID 62524559
1-[[5-(ethylaminomethyl)furan-2-yl]methyl]-N,N-dimethylpiperidin-4-amine
CID 62432459
1-[(5-methylfuran-2-yl)methyl]-4-methylsulfonylpiperidine
CID 121183067
methyl 4-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methylcarbamoylamino]benzoate
CID 118789012
1,3-dimethyl-N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]-2,6-dioxopyrimidine-4-carboxamide
CID 72914217
N-[[1-[(6-methyl-2-pyridinyl)methyl]piperidin-4-yl]methyl]ethanamine
CID 79266938
N-[[1-[(4-bromothiophen-2-yl)methyl]piperidin-4-yl]methyl]ethanamine;hydrochloride
CID 119928141
N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]ethanamine;hydrochloride
CID 119927879

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine?
The IUPAC name of N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine (CID 54793664) is N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine is CCNCC1CCN(Cc2ccc(C)o2)CC1.
What is the InChIKey of N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine?
The InChIKey is FAXCDJZBVSNOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-15-10-13-6-8-16(9-7-13)11-14-5-4-12(2)17-14/h4-5,13,15H,3,6-11H2,1-2H3.
What are the key properties of N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine?
N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(5-methylfuran-2-yl)methyl]piperidin-4-yl]methyl]ethanamine is sourced from PubChem (CID 54793664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).