1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine

C15H26N2O — CID 62937540

IUPAC1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine
SMILESCc1ccc(C(C(C)N)N2CCC(C)(C)CC2)o1
InChIInChI=1S/C15H26N2O/c1-11-5-6-13(18-11)14(12(2)16)17-9-7-15(3,4)8-10-17/h5-6,12,14H,7-10,16H2,1-4H3
InChIKeyUQAIEGCKIQEGJS-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.10
Rot. Bonds3

About 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine

1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine (PubChem CID 62937540) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine
PubChem CID62937540
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine
SMILESCc1ccc(C(C(C)N)N2CCC(C)(C)CC2)o1
InChIInChI=1S/C15H26N2O/c1-11-5-6-13(18-11)14(12(2)16)17-9-7-15(3,4)8-10-17/h5-6,12,14H,7-10,16H2,1-4H3
InChIKeyUQAIEGCKIQEGJS-UHFFFAOYSA-N
XLogP3.10
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine?
The IUPAC name of 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine (CID 62937540) is 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine.
What is the SMILES notation for 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine?
The canonical SMILES for 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine is Cc1ccc(C(C(C)N)N2CCC(C)(C)CC2)o1.
What is the InChIKey of 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine?
The InChIKey is UQAIEGCKIQEGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-11-5-6-13(18-11)14(12(2)16)17-9-7-15(3,4)8-10-17/h5-6,12,14H,7-10,16H2,1-4H3.
What are the key properties of 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine?
1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethylpiperidin-1-yl)-1-(5-methylfuran-2-yl)propan-2-amine is sourced from PubChem (CID 62937540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).