2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide

C14H27N3O2 — CID 63053798

IUPAC2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide
SMILESCCOC1CCCN(CCC(NC2CC2)C(N)=O)C1
InChIInChI=1S/C14H27N3O2/c1-2-19-12-4-3-8-17(10-12)9-7-13(14(15)18)16-11-5-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyKCEUCPIJQMKOSP-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.48
Rot. Bonds8

About 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide

2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide (PubChem CID 63053798) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide
PubChem CID63053798
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide
SMILESCCOC1CCCN(CCC(NC2CC2)C(N)=O)C1
InChIInChI=1S/C14H27N3O2/c1-2-19-12-4-3-8-17(10-12)9-7-13(14(15)18)16-11-5-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18)
InChIKeyKCEUCPIJQMKOSP-UHFFFAOYSA-N
XLogP0.48
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-4-(3-methoxy-3-methylpiperidin-1-yl)butanamide
CID 107394779
2-(cyclopropylamino)-4-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 63055622
4-(4-tert-butylpiperidin-1-yl)-2-(cyclopropylamino)butanamide
CID 63054348
methyl 2-(ethylamino)-4-(3-propoxypiperidin-1-yl)butanoate
CID 63054326
2-(cyclopropylamino)-4-(4-cyclopropylpiperazin-1-yl)butanamide
CID 55144900
ethyl 2-(cyclopropylamino)-4-(4,4-dimethylazepan-1-yl)butanoate
CID 65282142
2-(cyclopropylamino)-4-[(2S,6R)-2,6-dimethylpiperidin-1-yl]butanamide
CID 104968607
ethyl 2-(cyclopropylamino)-4-(4-methylpiperidin-1-yl)butanoate
CID 63027972
ethyl 4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-(cyclopropylamino)butanoate
CID 115561433
1-(3-ethoxypiperidin-1-yl)butan-2-one
CID 62040575
2-(cyclopropylamino)-4-(4-methylcyclohexyl)oxybutanamide
CID 63040789
methyl 4-(3-methoxypiperidin-1-yl)-2-(propan-2-ylamino)butanoate
CID 102966487

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide?
The IUPAC name of 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide (CID 63053798) is 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide is CCOC1CCCN(CCC(NC2CC2)C(N)=O)C1.
What is the InChIKey of 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide?
The InChIKey is KCEUCPIJQMKOSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-2-19-12-4-3-8-17(10-12)9-7-13(14(15)18)16-11-5-6-11/h11-13,16H,2-10H2,1H3,(H2,15,18).
What are the key properties of 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide?
2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide has a molecular weight of 269.39 g/mol, XLogP of 0.48, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(3-ethoxypiperidin-1-yl)butanamide is sourced from PubChem (CID 63053798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).