N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine

C15H26N2O — CID 83380875

IUPACN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C15H26N2O/c1-13(2)11-16-12-14(15-7-6-10-18-15)17-8-4-3-5-9-17/h6-7,10,13-14,16H,3-5,8-9,11-12H2,1-2H3
InChIKeySSRKUBNRLIJBDB-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.05
Rot. Bonds6

About N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine (PubChem CID 83380875) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
PubChem CID83380875
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(c1ccco1)N1CCCCC1
InChIInChI=1S/C15H26N2O/c1-13(2)11-16-12-14(15-7-6-10-18-15)17-8-4-3-5-9-17/h6-7,10,13-14,16H,3-5,8-9,11-12H2,1-2H3
InChIKeySSRKUBNRLIJBDB-UHFFFAOYSA-N
XLogP3.05
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azepan-1-yl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 22692497
(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
CID 2106497
N-(cyclopropylmethyl)-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 43654889
2-(furan-2-yl)-N-[(4-methylphenyl)methyl]-2-pyrrolidin-1-ylethanamine
CID 43181232
N-[(4-bromothiophen-2-yl)methyl]-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 17483105
2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol
CID 81399970
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pentan-2-amine
CID 43202553
(2S)-2-(furan-2-yl)-N-[(5-methylthiophen-2-yl)methyl]-2-pyrrolidin-1-ylethanamine
CID 9453091
2-(furan-2-yl)-2-pyrrolidin-1-yl-N-(thiophen-3-ylmethyl)ethanamine
CID 43181246
2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]propanoic acid
CID 66174492
N-[(4-chlorophenyl)methyl]-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 43081423
4-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]phenol
CID 43181226

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine (CID 83380875) is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine is CC(C)CNCC(c1ccco1)N1CCCCC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine?
The InChIKey is SSRKUBNRLIJBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-13(2)11-16-12-14(15-7-6-10-18-15)17-8-4-3-5-9-17/h6-7,10,13-14,16H,3-5,8-9,11-12H2,1-2H3.
What are the key properties of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine?
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine is sourced from PubChem (CID 83380875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).