N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide

C11H23N3O2 — CID 107206795

IUPACN-(5-aminopentyl)-N-methylmorpholine-4-carboxamide
SMILESCN(CCCCCN)C(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O2/c1-13(6-4-2-3-5-12)11(15)14-7-9-16-10-8-14/h2-10,12H2,1H3
InChIKeyAQJZTRFORRTOEX-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.50
Rot. Bonds5

About N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide

N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide (PubChem CID 107206795) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(5-aminopentyl)-N-methylmorpholine-4-carboxamide
PubChem CID107206795
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN-(5-aminopentyl)-N-methylmorpholine-4-carboxamide
SMILESCN(CCCCCN)C(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O2/c1-13(6-4-2-3-5-12)11(15)14-7-9-16-10-8-14/h2-10,12H2,1H3
InChIKeyAQJZTRFORRTOEX-UHFFFAOYSA-N
XLogP0.50
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-aminopentyl)-N-methylpiperidine-1-carboxamide
CID 107206810
N-(3-aminopropyl)-N-methylpyrrolidine-1-carboxamide
CID 79160813
N-(3-aminopropyl)-N-methylpiperidine-1-carboxamide
CID 79155525
tert-butyl N-methyl-N-[4-[methyl(morpholine-4-carbonyl)amino]butyl]carbamate
CID 19753787
N-[(Z)-5-aminopent-4-enyl]-N-methylmorpholine-4-carboxamide;propane
CID 143443518
N-(2-methoxyethyl)-N-methylmorpholine-4-carboxamide
CID 115589220
N-(2-aminoethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 79155314
2-[3-aminopropyl(ethyl)amino]-1-morpholin-4-ylpropan-1-one
CID 43137254
6-amino-1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)hexan-1-one
CID 4861310
5-amino-1-morpholin-4-ylpentan-1-one
CID 54404632
N-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
CID 3091
2-[3-aminopropyl(2-methoxyethyl)amino]-1-morpholin-4-ylpropan-1-one
CID 63287403

Frequently Asked Questions

What is the IUPAC name of N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide?
The IUPAC name of N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide (CID 107206795) is N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide.
What is the SMILES notation for N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide?
The canonical SMILES for N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide is CN(CCCCCN)C(=O)N1CCOCC1.
What is the InChIKey of N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide?
The InChIKey is AQJZTRFORRTOEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-13(6-4-2-3-5-12)11(15)14-7-9-16-10-8-14/h2-10,12H2,1H3.
What are the key properties of N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide?
N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide has a molecular weight of 229.32 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide is sourced from PubChem (CID 107206795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).