N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine

C16H28N2O — CID 83062404

IUPACN-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
SMILESCCCC1CCCCN1Cc1cc(CNCC)co1
InChIInChI=1S/C16H28N2O/c1-3-7-15-8-5-6-9-18(15)12-16-10-14(13-19-16)11-17-4-2/h10,13,15,17H,3-9,11-12H2,1-2H3
InChIKeyIXDVUSSKKLAPDN-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.54
Rot. Bonds7

About N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine

N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine (PubChem CID 83062404) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
PubChem CID83062404
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
SMILESCCCC1CCCCN1Cc1cc(CNCC)co1
InChIInChI=1S/C16H28N2O/c1-3-7-15-8-5-6-9-18(15)12-16-10-14(13-19-16)11-17-4-2/h10,13,15,17H,3-9,11-12H2,1-2H3
InChIKeyIXDVUSSKKLAPDN-UHFFFAOYSA-N
XLogP3.54
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine with MolForge

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Related Compounds

N-[[5-[(2-ethylpiperidin-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 62420838
N-[[5-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]furan-3-yl]methyl]propan-1-amine
CID 62888715
N-[[5-[(2-ethylazepan-1-yl)methyl]furan-3-yl]methyl]propan-2-amine
CID 104692369
N-[[5-[(2-ethylpiperidin-1-yl)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 62417960
N-[[5-[(2,3-dimethylpiperidin-1-yl)methyl]furan-3-yl]methyl]propan-1-amine
CID 62412126
N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine
CID 55074754
N-[[5-[(4-tert-butylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine
CID 62411943
5-[(2-propylpiperidin-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
CID 83056535
(2S)-1-benzyl-2-propylpiperidine
CID 71407726
N-[[5-[(4-tert-butylpiperazin-1-yl)methyl]furan-3-yl]methyl]ethanamine
CID 62463352
N-[[3-[(2-propylpiperidin-1-yl)methyl]furan-2-yl]methyl]propan-1-amine
CID 83061390
1-[1-[[4-(aminomethyl)furan-2-yl]methyl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 55128528

Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine (CID 83062404) is N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine is CCCC1CCCCN1Cc1cc(CNCC)co1.
What is the InChIKey of N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine?
The InChIKey is IXDVUSSKKLAPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-3-7-15-8-5-6-9-18(15)12-16-10-14(13-19-16)11-17-4-2/h10,13,15,17H,3-9,11-12H2,1-2H3.
What are the key properties of N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine?
N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine has a molecular weight of 264.41 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2-propylpiperidin-1-yl)methyl]furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 83062404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).