2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide

C14H29N3O2 — CID 55144705

IUPAC2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide
SMILESCCCOC1CCCN(CCC(NCC)C(N)=O)C1
InChIInChI=1S/C14H29N3O2/c1-3-10-19-12-6-5-8-17(11-12)9-7-13(14(15)18)16-4-2/h12-13,16H,3-11H2,1-2H3,(H2,15,18)
InChIKeyQMNDTFWNUWZXDZ-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.73
Rot. Bonds9

About 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide

2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide (PubChem CID 55144705) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide.

Molecular Properties

Compound Name2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide
PubChem CID55144705
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC Name2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide
SMILESCCCOC1CCCN(CCC(NCC)C(N)=O)C1
InChIInChI=1S/C14H29N3O2/c1-3-10-19-12-6-5-8-17(11-12)9-7-13(14(15)18)16-4-2/h12-13,16H,3-11H2,1-2H3,(H2,15,18)
InChIKeyQMNDTFWNUWZXDZ-UHFFFAOYSA-N
XLogP0.73
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide?
The IUPAC name of 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide (CID 55144705) is 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide.
What is the SMILES notation for 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide?
The canonical SMILES for 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide is CCCOC1CCCN(CCC(NCC)C(N)=O)C1.
What is the InChIKey of 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide?
The InChIKey is QMNDTFWNUWZXDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-3-10-19-12-6-5-8-17(11-12)9-7-13(14(15)18)16-4-2/h12-13,16H,3-11H2,1-2H3,(H2,15,18).
What are the key properties of 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide?
2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide has a molecular weight of 271.40 g/mol, XLogP of 0.73, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanamide is sourced from PubChem (CID 55144705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).