N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide

C12H25N3O2 — CID 106141337

IUPACN-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide
SMILESCC(C)(CCCN)CNC(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O2/c1-12(2,4-3-5-13)10-14-11(16)15-6-8-17-9-7-15/h3-10,13H2,1-2H3,(H,14,16)
InChIKeyJDNIZSZYYVHDGO-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.79
Rot. Bonds5

About N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide

N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide (PubChem CID 106141337) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide
PubChem CID106141337
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC NameN-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide
SMILESCC(C)(CCCN)CNC(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O2/c1-12(2,4-3-5-13)10-14-11(16)15-6-8-17-9-7-15/h3-10,13H2,1-2H3,(H,14,16)
InChIKeyJDNIZSZYYVHDGO-UHFFFAOYSA-N
XLogP0.79
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-hydroxy-2,2-dimethylpentyl)morpholine-4-carboxamide
CID 103896247
N-(4-hydroxy-2,2-dimethylbutyl)morpholine-4-carboxamide
CID 103713760
2-hydroxy-2-methyl-3-(morpholine-4-carbonylamino)propanoic acid
CID 66173250
N-(3-amino-2,2-dimethylpropyl)azepane-1-carboxamide
CID 115365844
6-amino-4,4-dimethyl-1-(1,4-oxazepan-4-yl)hexan-1-one
CID 65291131
N-(3,3-dimethyl-2-oxobutyl)morpholine-4-carboxamide
CID 79152144
N-(4-hydroxy-2,2-dimethylbutyl)piperidine-1-carboxamide
CID 103713759
N-(4-aminobutanoyl)morpholine-4-carboxamide
CID 82509016
N-[2-(4-fluorophenyl)-2-hydroxypropyl]morpholine-4-carboxamide
CID 110291409
5-amino-1-morpholin-4-ylpentan-1-one
CID 54404632
N-(2-amino-2-oxoethyl)morpholine-4-carboxamide
CID 115575796
N-propylmorpholine-4-carboxamide
CID 3410822

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide?
The IUPAC name of N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide (CID 106141337) is N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide?
The canonical SMILES for N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide is CC(C)(CCCN)CNC(=O)N1CCOCC1.
What is the InChIKey of N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide?
The InChIKey is JDNIZSZYYVHDGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-12(2,4-3-5-13)10-14-11(16)15-6-8-17-9-7-15/h3-10,13H2,1-2H3,(H,14,16).
What are the key properties of N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide?
N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide has a molecular weight of 243.35 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,2-dimethylpentyl)morpholine-4-carboxamide is sourced from PubChem (CID 106141337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).