1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine

C16H28N2O — CID 63133032

IUPAC1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine
SMILESCCCC1(CNC(C)Cc2ccco2)CCCNC1
InChIInChI=1S/C16H28N2O/c1-3-7-16(8-5-9-17-12-16)13-18-14(2)11-15-6-4-10-19-15/h4,6,10,14,17-18H,3,5,7-9,11-13H2,1-2H3
InChIKeyAWXWAQSGUCHVAO-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.97
Rot. Bonds7

About 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine

1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine (PubChem CID 63133032) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine
PubChem CID63133032
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine
SMILESCCCC1(CNC(C)Cc2ccco2)CCCNC1
InChIInChI=1S/C16H28N2O/c1-3-7-16(8-5-9-17-12-16)13-18-14(2)11-15-6-4-10-19-15/h4,6,10,14,17-18H,3,5,7-9,11-13H2,1-2H3
InChIKeyAWXWAQSGUCHVAO-UHFFFAOYSA-N
XLogP2.97
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]propan-2-amine
CID 63142842
2-(furan-2-yl)-N-[(3-propylpyrrolidin-3-yl)methyl]ethanamine
CID 63142896
N-[2-[1-(aminomethyl)cyclobutyl]ethyl]-1-(furan-2-yl)propan-2-amine
CID 81170029
1-(furan-2-yl)-N-[(1-propylcyclobutyl)methyl]ethanamine
CID 115893829
1,1-dicyclopropyl-N-[(3-propylpiperidin-3-yl)methyl]methanamine
CID 63133124
N-[[1-(furan-2-ylmethyl)cyclohexyl]methyl]-2-methylpropan-1-amine
CID 63000497
1-(furan-2-yl)-N-[(1-propylcyclopropyl)methyl]methanamine
CID 115696278
N-[1-(furan-2-yl)propan-2-yl]-2,3-dimethylbutan-1-amine
CID 64568053
N-[(3-ethylpyrrolidin-3-yl)methyl]-1-(furan-2-yl)methanamine
CID 63143229
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
CID 63134948
N-[(3-ethylpiperidin-3-yl)methyl]propan-2-amine
CID 63133337
N-(furan-2-ylmethyl)-N-methyl-3-propylpiperidine-3-carboxamide
CID 55165654

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine?
The IUPAC name of 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine (CID 63133032) is 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine?
The canonical SMILES for 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine is CCCC1(CNC(C)Cc2ccco2)CCCNC1.
What is the InChIKey of 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine?
The InChIKey is AWXWAQSGUCHVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-3-7-16(8-5-9-17-12-16)13-18-14(2)11-15-6-4-10-19-15/h4,6,10,14,17-18H,3,5,7-9,11-13H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine?
1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine has a molecular weight of 264.41 g/mol, XLogP of 2.97, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(3-propylpiperidin-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 63133032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).