1-(4-aminopiperidin-1-yl)nonan-1-one

C14H28N2O — CID 65449656

IUPAC1-(4-aminopiperidin-1-yl)nonan-1-one
SMILESCCCCCCCCC(=O)N1CCC(N)CC1
InChIInChI=1S/C14H28N2O/c1-2-3-4-5-6-7-8-14(17)16-11-9-13(15)10-12-16/h13H,2-12,15H2,1H3
InChIKeyGAPDDYGVZCOOLC-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.69
Rot. Bonds7

About 1-(4-aminopiperidin-1-yl)nonan-1-one

1-(4-aminopiperidin-1-yl)nonan-1-one (PubChem CID 65449656) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)nonan-1-one.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)nonan-1-one
PubChem CID65449656
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-(4-aminopiperidin-1-yl)nonan-1-one
SMILESCCCCCCCCC(=O)N1CCC(N)CC1
InChIInChI=1S/C14H28N2O/c1-2-3-4-5-6-7-8-14(17)16-11-9-13(15)10-12-16/h13H,2-12,15H2,1H3
InChIKeyGAPDDYGVZCOOLC-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3-aminopyrrolidin-1-yl)dodecan-1-one
CID 65428474
1-(4-ethylpiperidin-1-yl)octan-1-one
CID 166490088
1-(4-methylpiperidin-1-yl)tetradecan-1-one
CID 10425459
1-[4-(bromomethyl)piperidin-1-yl]nonan-1-one
CID 80677529
1-(4-octadecanoylpiperazin-1-yl)octadecan-1-one
CID 550164
1-[(3R)-3-aminopyrrolidin-1-yl]pentan-1-one
CID 81469401
1-(4-bromopiperidin-1-yl)decan-1-one
CID 80661862
1-(4-aminopiperidin-1-yl)-4-(dipropylamino)butan-1-one
CID 82042946
1-(4-amino-3-methylpiperidin-1-yl)octan-1-one
CID 79880598
6-amino-1-(4-butylpiperidin-1-yl)hexan-1-one
CID 170126914
1-pyrrolidin-1-ylheptadecan-1-one
CID 574649
1-[4-(methylamino)piperidin-1-yl]hexan-1-one
CID 60818219

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminopiperidin-1-yl)nonan-1-one?
The IUPAC name of 1-(4-aminopiperidin-1-yl)nonan-1-one (CID 65449656) is 1-(4-aminopiperidin-1-yl)nonan-1-one.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)nonan-1-one?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)nonan-1-one is CCCCCCCCC(=O)N1CCC(N)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)nonan-1-one?
The InChIKey is GAPDDYGVZCOOLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-3-4-5-6-7-8-14(17)16-11-9-13(15)10-12-16/h13H,2-12,15H2,1H3.
What are the key properties of 1-(4-aminopiperidin-1-yl)nonan-1-one?
1-(4-aminopiperidin-1-yl)nonan-1-one has a molecular weight of 240.39 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)nonan-1-one is sourced from PubChem (CID 65449656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).