N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide

C11H23N3O2 — CID 106357280

IUPACN-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide
SMILESCC(C)C(CCN)NC(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O2/c1-9(2)10(3-4-12)13-11(15)14-5-7-16-8-6-14/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyAQIHMRVAMKTDEY-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.40
Rot. Bonds4

About N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide

N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide (PubChem CID 106357280) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide
PubChem CID106357280
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide
SMILESCC(C)C(CCN)NC(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O2/c1-9(2)10(3-4-12)13-11(15)14-5-7-16-8-6-14/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyAQIHMRVAMKTDEY-UHFFFAOYSA-N
XLogP0.40
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 79155057
N-propan-2-ylmorpholine-4-carboxamide
CID 3411412
N-(4-methylsulfanylbutan-2-yl)morpholine-4-carboxamide
CID 115640219
N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
CID 115665185
methyl (2S)-3-methyl-2-(morpholine-4-carbonylamino)butanoate
CID 940643
N-(1-hydroxy-4-methylpentan-3-yl)pyrrolidine-1-carboxamide
CID 103713703
4-amino-2-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)butanamide
CID 113408473
3-methyl-2-(morpholine-4-carbonylamino)butanoyl iodide
CID 129144228
N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 111444624
N-[(2R)-octan-2-yl]morpholine-4-carboxamide
CID 7815302
diethyl 2-(morpholine-4-carbonylamino)propanedioate
CID 79151888
N-(1-amino-4-methylpentan-3-yl)-1,4-dioxane-2-carboxamide
CID 106356890

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide?
The IUPAC name of N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide (CID 106357280) is N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide is CC(C)C(CCN)NC(=O)N1CCOCC1.
What is the InChIKey of N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide?
The InChIKey is AQIHMRVAMKTDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-9(2)10(3-4-12)13-11(15)14-5-7-16-8-6-14/h9-10H,3-8,12H2,1-2H3,(H,13,15).
What are the key properties of N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide?
N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide has a molecular weight of 229.32 g/mol, XLogP of 0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-3-yl)morpholine-4-carboxamide is sourced from PubChem (CID 106357280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).