N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide

C11H22N2O3 — CID 106161275

IUPACN-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide
SMILESCC(CO)CCCNC(=O)C1COCCN1
InChIInChI=1S/C11H22N2O3/c1-9(7-14)3-2-4-13-11(15)10-8-16-6-5-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15)
InChIKeyDWLRANXFOVRPKQ-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.50
Rot. Bonds6

About N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide

N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide (PubChem CID 106161275) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide
PubChem CID106161275
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide
SMILESCC(CO)CCCNC(=O)C1COCCN1
InChIInChI=1S/C11H22N2O3/c1-9(7-14)3-2-4-13-11(15)10-8-16-6-5-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15)
InChIKeyDWLRANXFOVRPKQ-UHFFFAOYSA-N
XLogP-0.50
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-[(2R)-1-hydroxypropan-2-yl]morpholine-3-carboxamide
CID 107218691
N-(4-hydroxybutan-2-yl)morpholine-3-carboxamide
CID 83177558
(3S)-N-(2-methoxyethyl)morpholine-3-carboxamide
CID 96998631
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]morpholine-3-carboxamide
CID 119840985
(3R)-N-(2-aminoethyl)morpholine-3-carboxamide;hydrochloride
CID 130616444
N-[2-(propan-2-ylsulfamoyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119758877
(3R)-N-[(2R)-2-methylsulfanylpropyl]morpholine-3-carboxamide
CID 99596683
2-[[(3S)-morpholine-3-carbonyl]amino]ethyl acetate
CID 118107617
N-(3-cyclopentyl-3-ethoxypropyl)morpholine-3-carboxamide
CID 119818458
N-[3-[ethylsulfonyl(methyl)amino]propyl]morpholine-3-carboxamide;hydrochloride
CID 119728906
2-(morpholine-3-carbonylamino)ethyl carbamate
CID 83209608

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide?
The IUPAC name of N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide (CID 106161275) is N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide?
The canonical SMILES for N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide is CC(CO)CCCNC(=O)C1COCCN1.
What is the InChIKey of N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide?
The InChIKey is DWLRANXFOVRPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9(7-14)3-2-4-13-11(15)10-8-16-6-5-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15).
What are the key properties of N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide?
N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide has a molecular weight of 230.31 g/mol, XLogP of -0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide is sourced from PubChem (CID 106161275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).