N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide

C12H24N2O3 — CID 111119288

IUPACN-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide
SMILESCCCCCN(CCO)C(=O)N1CCOCC1
InChIInChI=1S/C12H24N2O3/c1-2-3-4-5-13(6-9-15)12(16)14-7-10-17-11-8-14/h15H,2-11H2,1H3
InChIKeyDPTGZTDCAFMCFP-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.92
Rot. Bonds6

About N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide

N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide (PubChem CID 111119288) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide
PubChem CID111119288
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide
SMILESCCCCCN(CCO)C(=O)N1CCOCC1
InChIInChI=1S/C12H24N2O3/c1-2-3-4-5-13(6-9-15)12(16)14-7-10-17-11-8-14/h15H,2-11H2,1H3
InChIKeyDPTGZTDCAFMCFP-UHFFFAOYSA-N
XLogP0.92
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.92
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-butyl-N-[2-[butyl(morpholine-4-carbonyl)amino]ethyl]morpholine-4-carboxamide
CID 3091
N-(2-hydroxyethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 115608967
N-butyl-N-(2-hydroxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylacetamide
CID 61444420
N-(5-aminopentyl)-N-methylmorpholine-4-carboxamide
CID 107206795
N-(2-hydroxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-N-propylacetamide
CID 61425142
N-butylacetamide;1-morpholin-4-ylethanone;N-pentyl-N-propylacetamide
CID 142117227
4-[2-hydroxyethyl(propyl)amino]-1-morpholin-4-ylbutan-1-one
CID 62014831
2-[1,4-oxazepane-4-carbonyl(propyl)amino]acetic acid
CID 62967639
ethane;1-morpholin-4-ylhexan-1-one
CID 143214280
1-morpholin-4-ylheptan-1-one;hydrochloride
CID 175124060
N-ethyl-N-(2-ethylbutyl)morpholine-4-carboxamide
CID 115589059
N-(2-hydroxyethyl)-2,2-dimethyl-N-pentylpropanamide
CID 59440869

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide (CID 111119288) is N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide is CCCCCN(CCO)C(=O)N1CCOCC1.
What is the InChIKey of N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide?
The InChIKey is DPTGZTDCAFMCFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-2-3-4-5-13(6-9-15)12(16)14-7-10-17-11-8-14/h15H,2-11H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide?
N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide has a molecular weight of 244.33 g/mol, XLogP of 0.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-pentylmorpholine-4-carboxamide is sourced from PubChem (CID 111119288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).