1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine

C18H25N3O — CID 125445625

IUPAC1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine
SMILESCc1cccnc1[C@@H](C)NC1CCN(Cc2ccco2)CC1
InChIInChI=1S/C18H25N3O/c1-14-5-3-9-19-18(14)15(2)20-16-7-10-21(11-8-16)13-17-6-4-12-22-17/h3-6,9,12,15-16,20H,7-8,10-11,13H2,1-2H3/t15-/m1/s1
InChIKeyAKALYDRNYDXDOI-OAHLLOKOSA-N
MW299.42 g/mol
LogP3.30
Rot. Bonds5

About 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine

1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine (PubChem CID 125445625) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine
PubChem CID125445625
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC Name1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine
SMILESCc1cccnc1[C@@H](C)NC1CCN(Cc2ccco2)CC1
InChIInChI=1S/C18H25N3O/c1-14-5-3-9-19-18(14)15(2)20-16-7-10-21(11-8-16)13-17-6-4-12-22-17/h3-6,9,12,15-16,20H,7-8,10-11,13H2,1-2H3/t15-/m1/s1
InChIKeyAKALYDRNYDXDOI-OAHLLOKOSA-N
XLogP3.30
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-ylmethyl)-N-methylpiperidin-4-amine;hydrochloride
CID 86253291
1-benzyl-N-[1-(3-methyl-2-pyridinyl)propyl]piperidin-4-amine
CID 50979377
N-[1-(4,5-dimethyl-1,3-thiazol-2-yl)propyl]-1-(furan-2-ylmethyl)piperidin-4-amine
CID 56710911
1-[(2-fluorophenyl)methyl]-N-[(1S)-1-(3-methylpyrazin-2-yl)ethyl]piperidin-4-amine
CID 129433668
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788
4-[(3R)-1-(furan-2-ylmethyl)pyrrolidin-3-yl]-2-(2-methylphenyl)pyridine
CID 95127720
N-[1-(furan-2-ylmethyl)piperidin-4-yl]-2-(methylamino)pyridine-4-carboxamide
CID 77093957
N-(furan-2-ylmethyl)-1-(pyridin-4-ylmethyl)piperidin-4-amine
CID 24732692
3-[1-(furan-2-ylmethyl)piperidin-4-yl]-1-methyl-1-(quinolin-6-ylmethyl)urea
CID 122563843
N-[(1S)-1-(furan-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 81403823
1-(furan-2-ylmethyl)-N-[(2S)-1-pyrazin-2-ylpropan-2-yl]piperidine-4-carboxamide
CID 97190312
[2-(furan-2-yl)-1-(3-methyl-2-pyridinyl)ethyl]hydrazine
CID 105209272

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine?
The IUPAC name of 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine (CID 125445625) is 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine is Cc1cccnc1[C@@H](C)NC1CCN(Cc2ccco2)CC1.
What is the InChIKey of 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine?
The InChIKey is AKALYDRNYDXDOI-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H25N3O/c1-14-5-3-9-19-18(14)15(2)20-16-7-10-21(11-8-16)13-17-6-4-12-22-17/h3-6,9,12,15-16,20H,7-8,10-11,13H2,1-2H3/t15-/m1/s1.
What are the key properties of 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine?
1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine has a molecular weight of 299.42 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-N-[(1R)-1-(3-methyl-2-pyridinyl)ethyl]piperidin-4-amine is sourced from PubChem (CID 125445625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).