N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide

C14H28N2O3 — CID 60500354

IUPACN-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide
SMILESCCOCCCNC(=O)C1CCN(CCCO)CC1
InChIInChI=1S/C14H28N2O3/c1-2-19-12-3-7-15-14(18)13-5-9-16(10-6-13)8-4-11-17/h13,17H,2-12H2,1H3,(H,15,18)
InChIKeyXBNOXFKNSYDGCS-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.62
Rot. Bonds9

About N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide

N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide (PubChem CID 60500354) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide
PubChem CID60500354
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC NameN-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide
SMILESCCOCCCNC(=O)C1CCN(CCCO)CC1
InChIInChI=1S/C14H28N2O3/c1-2-19-12-3-7-15-14(18)13-5-9-16(10-6-13)8-4-11-17/h13,17H,2-12H2,1H3,(H,15,18)
InChIKeyXBNOXFKNSYDGCS-UHFFFAOYSA-N
XLogP0.62
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(3-hydroxypropyl)-N-propylpiperidine-4-carboxamide
CID 110884748
1-butyl-N-(2-hydroxyethyl)piperidine-4-carboxamide
CID 54039617
N-(3-ethoxypropyl)-1-(piperidin-4-ylmethyl)piperidine-4-carboxamide
CID 119930228
1-(2-ethoxyethyl)-N-methylpiperidine-4-carboxamide
CID 134055126
1-butyl-N-propylpiperidine-4-carboxamide
CID 155706109
(3R)-N-(3-ethoxypropyl)-1-methylpiperidine-3-carboxamide
CID 99970155
N-(3-ethoxypropyl)-1-(3,3,3-trifluoropropanoyl)piperidine-4-carboxamide
CID 86985142
methyl 1-(2-ethoxyethyl)piperidine-4-carboxylate
CID 60691218
cis-(1S,3R)-1-N,3-N-bis(3-ethoxypropyl)cyclohexane-1,3-dicarboxamide
CID 94820992
1-[(2S)-2-amino-4-methylpentanoyl]-N-(3-ethoxypropyl)piperidine-4-carboxamide;hydrochloride
CID 119720899
1-[(3-ethoxyphenyl)methyl]-N-(3-ethoxypropyl)piperidine-4-carboxamide
CID 43923975
N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide
CID 176985091

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide?
The IUPAC name of N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide (CID 60500354) is N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide?
The canonical SMILES for N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide is CCOCCCNC(=O)C1CCN(CCCO)CC1.
What is the InChIKey of N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide?
The InChIKey is XBNOXFKNSYDGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-2-19-12-3-7-15-14(18)13-5-9-16(10-6-13)8-4-11-17/h13,17H,2-12H2,1H3,(H,15,18).
What are the key properties of N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide?
N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 0.62, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide is sourced from PubChem (CID 60500354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).