5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine

C12H26N2O — CID 102963876

IUPAC5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
SMILESCOC1CCCN(CC(C)CCCN)C1
InChIInChI=1S/C12H26N2O/c1-11(5-3-7-13)9-14-8-4-6-12(10-14)15-2/h11-12H,3-10,13H2,1-2H3
InChIKeyIEJPRZBHGFQJDA-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.47
Rot. Bonds6

About 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine

5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine (PubChem CID 102963876) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine.

Molecular Properties

Compound Name5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
PubChem CID102963876
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine
SMILESCOC1CCCN(CC(C)CCCN)C1
InChIInChI=1S/C12H26N2O/c1-11(5-3-7-13)9-14-8-4-6-12(10-14)15-2/h11-12H,3-10,13H2,1-2H3
InChIKeyIEJPRZBHGFQJDA-UHFFFAOYSA-N
XLogP1.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-3-(3-methoxypiperidin-1-yl)propan-1-amine
CID 106115075
4-methyl-5-[3-(trifluoromethyl)piperidin-1-yl]pentan-1-amine
CID 113440626
3-(3-methoxypiperidin-1-yl)-2-methylpropanethioamide
CID 102958133
2-amino-3-(3-methoxypiperidin-1-yl)propan-1-ol
CID 102968945
4-methyl-5-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
CID 103497584
1-(3-methoxypiperidin-1-yl)-3,3-dimethylbutan-2-ol
CID 102966089
3-(3-methoxypiperidin-1-yl)-2-(propan-2-ylamino)propan-1-ol
CID 102968981
5-(3-methoxy-3-methylpiperidin-1-yl)-4-methylpentan-1-amine
CID 107393262
4-(3-methoxypyrrolidin-1-yl)butan-1-amine
CID 69155262
4-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-3-methylbutan-1-amine
CID 80544084
1-(3-methoxypiperidin-1-yl)-N-methylpentan-2-amine
CID 102965544
4-methyl-5-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 104681883

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine?
The IUPAC name of 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine (CID 102963876) is 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine.
What is the SMILES notation for 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine?
The canonical SMILES for 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine is COC1CCCN(CC(C)CCCN)C1.
What is the InChIKey of 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine?
The InChIKey is IEJPRZBHGFQJDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(5-3-7-13)9-14-8-4-6-12(10-14)15-2/h11-12H,3-10,13H2,1-2H3.
What are the key properties of 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine?
5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxypiperidin-1-yl)-4-methylpentan-1-amine is sourced from PubChem (CID 102963876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).