1-[3-(dipropylamino)propyl]piperidin-4-one

C14H28N2O — CID 18001996

IUPAC1-[3-(dipropylamino)propyl]piperidin-4-one
SMILESCCCN(CCC)CCCN1CCC(=O)CC1
InChIInChI=1S/C14H28N2O/c1-3-8-15(9-4-2)10-5-11-16-12-6-14(17)7-13-16/h3-13H2,1-2H3
InChIKeyAUARTKFNSYLOKQ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.16
Rot. Bonds8

About 1-[3-(dipropylamino)propyl]piperidin-4-one

1-[3-(dipropylamino)propyl]piperidin-4-one (PubChem CID 18001996) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[3-(dipropylamino)propyl]piperidin-4-one.

Molecular Properties

Compound Name1-[3-(dipropylamino)propyl]piperidin-4-one
PubChem CID18001996
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-[3-(dipropylamino)propyl]piperidin-4-one
SMILESCCCN(CCC)CCCN1CCC(=O)CC1
InChIInChI=1S/C14H28N2O/c1-3-8-15(9-4-2)10-5-11-16-12-6-14(17)7-13-16/h3-13H2,1-2H3
InChIKeyAUARTKFNSYLOKQ-UHFFFAOYSA-N
XLogP2.16
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

butane;1-butylpiperidin-4-one
CID 177152756
1-pentadecylpiperidin-4-one
CID 10267366
1-(4-butoxybutyl)piperidin-4-one
CID 70278532
N-[1-[3-(dibutylamino)propyl]piperidin-4-ylidene]hydroxylamine
CID 18002145
1-(5-butoxypentyl)piperidin-4-one
CID 18001872
1-(5-propoxypentyl)piperidin-4-one
CID 70277123
1-(6-butoxyhexyl)piperidin-4-one
CID 70277022
1-butylpyrrolidin-3-one
CID 23052762
1-(3-fluoropropyl)piperidin-4-one
CID 81105604
1-(2-ethoxyethyl)piperidin-4-one
CID 15410842
1-octylpiperidin-3-one;1-octylpiperidin-4-one
CID 68829117
1-hex-5-ynylpiperidin-4-one
CID 106210482

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dipropylamino)propyl]piperidin-4-one?
The IUPAC name of 1-[3-(dipropylamino)propyl]piperidin-4-one (CID 18001996) is 1-[3-(dipropylamino)propyl]piperidin-4-one.
What is the SMILES notation for 1-[3-(dipropylamino)propyl]piperidin-4-one?
The canonical SMILES for 1-[3-(dipropylamino)propyl]piperidin-4-one is CCCN(CCC)CCCN1CCC(=O)CC1.
What is the InChIKey of 1-[3-(dipropylamino)propyl]piperidin-4-one?
The InChIKey is AUARTKFNSYLOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-8-15(9-4-2)10-5-11-16-12-6-14(17)7-13-16/h3-13H2,1-2H3.
What are the key properties of 1-[3-(dipropylamino)propyl]piperidin-4-one?
1-[3-(dipropylamino)propyl]piperidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.16, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dipropylamino)propyl]piperidin-4-one is sourced from PubChem (CID 18001996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).