4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide

C14H23N3O2 — CID 83261936

IUPAC4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide
SMILESC[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccco1
InChIInChI=1S/C14H23N3O2/c1-11(13-5-4-10-19-13)15-12-6-8-17(9-7-12)14(18)16(2)3/h4-5,10-12,15H,6-9H2,1-3H3/t11-/m0/s1
InChIKeyYGYXFKHANBITET-NSHDSACASA-N
MW265.36 g/mol
LogP2.08
Rot. Bonds3

About 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide

4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 83261936) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide
PubChem CID83261936
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide
SMILESC[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccco1
InChIInChI=1S/C14H23N3O2/c1-11(13-5-4-10-19-13)15-12-6-8-17(9-7-12)14(18)16(2)3/h4-5,10-12,15H,6-9H2,1-3H3/t11-/m0/s1
InChIKeyYGYXFKHANBITET-NSHDSACASA-N
XLogP2.08
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-(furan-2-yl)ethyl]-1-methylpiperidin-4-amine
CID 81403796
1-[4-[1-(furan-2-yl)ethylamino]piperidin-1-yl]-2-methoxyethanone
CID 43747621
N,N-dimethyl-4-[[(1R)-1-phenylethyl]amino]piperidine-1-carboxamide
CID 83206240
N,N-dimethyl-4-(1-phenylethylamino)piperidine-1-carboxamide
CID 83205698
N,N-dimethyl-4-[[(1R)-1-thiophen-2-ylethyl]amino]piperidine-1-carboxamide
CID 83261830
N,N-dimethyl-4-[1-(2-methylphenyl)ethylamino]piperidine-1-carboxamide
CID 83206943
N-[1-(furan-2-yl)ethyl]-1-methylazepan-4-amine
CID 65070258
N,N-dimethyl-4-[[(1S)-1-pyridin-2-ylethyl]amino]piperidine-1-carboxamide
CID 83262155
N-[(1R)-1-(furan-2-yl)ethyl]-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 81403840
N-[(1S)-1-(furan-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 81403823
N-[1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 43730440
N-[(1S)-1-(furan-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 81402923

Frequently Asked Questions

What is the IUPAC name of 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide (CID 83261936) is 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide is C[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccco1.
What is the InChIKey of 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is YGYXFKHANBITET-NSHDSACASA-N. The full InChI is InChI=1S/C14H23N3O2/c1-11(13-5-4-10-19-13)15-12-6-8-17(9-7-12)14(18)16(2)3/h4-5,10-12,15H,6-9H2,1-3H3/t11-/m0/s1.
What are the key properties of 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide?
4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(1S)-1-(furan-2-yl)ethyl]amino]-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 83261936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).