N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide

C14H26N2O3 — CID 79205196

IUPACN-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide
SMILESCCCCNC(=O)C1CCN(C(=O)CCCO)CC1
InChIInChI=1S/C14H26N2O3/c1-2-3-8-15-14(19)12-6-9-16(10-7-12)13(18)5-4-11-17/h12,17H,2-11H2,1H3,(H,15,19)
InChIKeyKHZJCNSEKOFTFO-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.91
Rot. Bonds7

About N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide

N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide (PubChem CID 79205196) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide
PubChem CID79205196
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide
SMILESCCCCNC(=O)C1CCN(C(=O)CCCO)CC1
InChIInChI=1S/C14H26N2O3/c1-2-3-8-15-14(19)12-6-9-16(10-7-12)13(18)5-4-11-17/h12,17H,2-11H2,1H3,(H,15,19)
InChIKeyKHZJCNSEKOFTFO-UHFFFAOYSA-N
XLogP0.91
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-butanoyl-N-(3-hydroxypropyl)piperidine-4-carboxamide
CID 61059999
1-[3-(ethylamino)propanoyl]-N-(3-hydroxypropyl)piperidine-4-carboxamide
CID 62835714
N-butyl-1-[2-(propan-2-ylamino)acetyl]piperidine-4-carboxamide
CID 60963263
1-[2-(butan-2-ylamino)acetyl]-N-butylpiperidine-4-carboxamide
CID 60963510
1-acetyl-N-(3-hydroxypropyl)piperidine-4-carboxamide
CID 43392702
3-[4-(3-hydroxypropylcarbamoyl)piperidin-1-yl]-3-oxopropanoic acid
CID 55049640
N-(3-hydroxypropyl)-1-[2-(propan-2-ylamino)acetyl]piperidine-4-carboxamide
CID 60953607
N-butyl-1-(3-chloro-2,2-dimethylpropanoyl)piperidine-4-carboxamide
CID 63665688
N-(2-benzamidoethyl)-1-pentanoylpiperidine-4-carboxamide
CID 46103996
2-[3-[4-(butylcarbamoyl)piperidin-1-yl]-3-oxopropyl]benzoic acid
CID 120691836
1-[(2S)-2-aminopropanoyl]-N-(3-hydroxypropyl)piperidine-4-carboxamide
CID 93376438
1-(2-amino-2-ethylbutanoyl)-N-butylpiperidine-4-carboxamide
CID 79813591

Frequently Asked Questions

What is the IUPAC name of N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide?
The IUPAC name of N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide (CID 79205196) is N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide?
The canonical SMILES for N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide is CCCCNC(=O)C1CCN(C(=O)CCCO)CC1.
What is the InChIKey of N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide?
The InChIKey is KHZJCNSEKOFTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-2-3-8-15-14(19)12-6-9-16(10-7-12)13(18)5-4-11-17/h12,17H,2-11H2,1H3,(H,15,19).
What are the key properties of N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide?
N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-1-(4-hydroxybutanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 79205196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).