N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide

C12H24N2O3 — CID 114150111

IUPACN-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide
SMILESCC(C)(CCCO)CNC(=O)C1COCCN1
InChIInChI=1S/C12H24N2O3/c1-12(2,4-3-6-15)9-14-11(16)10-8-17-7-5-13-10/h10,13,15H,3-9H2,1-2H3,(H,14,16)
InChIKeyKAWOGLRTYGTXGH-UHFFFAOYSA-N
MW244.33 g/mol
LogP-0.11
Rot. Bonds6

About N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide

N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide (PubChem CID 114150111) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide
PubChem CID114150111
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide
SMILESCC(C)(CCCO)CNC(=O)C1COCCN1
InChIInChI=1S/C12H24N2O3/c1-12(2,4-3-6-15)9-14-11(16)10-8-17-7-5-13-10/h10,13,15H,3-9H2,1-2H3,(H,14,16)
InChIKeyKAWOGLRTYGTXGH-UHFFFAOYSA-N
XLogP-0.11
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxy-2,2-dimethylbutyl)morpholine-3-carboxamide
CID 114125129
N-(2-methyl-2-methylsulfanylpropyl)morpholine-3-carboxamide
CID 115739814
methyl 2,2-dimethyl-3-(morpholine-3-carbonylamino)propanoate
CID 119789338
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-(4-hydroxybutan-2-yl)morpholine-3-carboxamide
CID 83177558
N-[2-(tert-butylamino)-2-oxoethyl]morpholine-3-carboxamide;hydrochloride
CID 119692656
(2R)-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
CID 106147826
N-(5-hydroxy-2,2-dimethylpentyl)-4-(methylamino)oxolane-3-carboxamide
CID 106148282
N-(2-chloroprop-2-enyl)morpholine-3-carboxamide
CID 115739704
N-[(2R)-1-hydroxypropan-2-yl]morpholine-3-carboxamide
CID 107218691
2-[[(3S)-morpholine-3-carbonyl]amino]ethyl acetate
CID 118107617
N-(5-hydroxy-4-methylpentyl)morpholine-3-carboxamide
CID 106161275

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide?
The IUPAC name of N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide (CID 114150111) is N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide.
What is the SMILES notation for N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide?
The canonical SMILES for N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide is CC(C)(CCCO)CNC(=O)C1COCCN1.
What is the InChIKey of N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide?
The InChIKey is KAWOGLRTYGTXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-12(2,4-3-6-15)9-14-11(16)10-8-17-7-5-13-10/h10,13,15H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide?
N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide has a molecular weight of 244.33 g/mol, XLogP of -0.11, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-2,2-dimethylpentyl)morpholine-3-carboxamide is sourced from PubChem (CID 114150111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).