N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide

C11H22N2O3 — CID 106147940

IUPACN-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide
SMILESCC(C)(CCO)CNC(=O)C1CNCCO1
InChIInChI=1S/C11H22N2O3/c1-11(2,3-5-14)8-13-10(15)9-7-12-4-6-16-9/h9,12,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyYTVUTQPKCCBSDB-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.50
Rot. Bonds5

About N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide

N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide (PubChem CID 106147940) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide
PubChem CID106147940
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide
SMILESCC(C)(CCO)CNC(=O)C1CNCCO1
InChIInChI=1S/C11H22N2O3/c1-11(2,3-5-14)8-13-10(15)9-7-12-4-6-16-9/h9,12,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyYTVUTQPKCCBSDB-UHFFFAOYSA-N
XLogP-0.50
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
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

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Related Compounds

(2R)-N-(azetidin-3-ylmethyl)morpholine-2-carboxamide;hydrochloride
CID 130702713
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-2-carboxamide
CID 107865565
N-(2-methyl-2-thiophen-2-ylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119787672
N-(4-hydroxy-2,2-dimethylbutyl)-4-methylpyrrolidine-3-carboxamide
CID 106147910
N-[2-(4-bromophenyl)sulfanyl-2-methylpropyl]morpholine-2-carboxamide;hydrochloride
CID 119806742
N-octylmorpholine-2-carboxamide
CID 115567943
(2R)-N-(2-aminopropyl)morpholine-2-carboxamide;hydrochloride
CID 130680040
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]morpholine-2-carboxamide
CID 119760050
N-[2-(cyclopropanecarbonylamino)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119687765
N-[(2-ethylphenyl)methyl]morpholine-2-carboxamide
CID 64682849
(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
N-(3-methylsulfanylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119706942

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide?
The IUPAC name of N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide (CID 106147940) is N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide.
What is the SMILES notation for N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide?
The canonical SMILES for N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide is CC(C)(CCO)CNC(=O)C1CNCCO1.
What is the InChIKey of N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide?
The InChIKey is YTVUTQPKCCBSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-11(2,3-5-14)8-13-10(15)9-7-12-4-6-16-9/h9,12,14H,3-8H2,1-2H3,(H,13,15).
What are the key properties of N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide?
N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide has a molecular weight of 230.31 g/mol, XLogP of -0.50, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2,2-dimethylbutyl)morpholine-2-carboxamide is sourced from PubChem (CID 106147940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).