2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one

C13H26N2O2 — CID 43372158

IUPAC2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one
SMILESCC(C)CC(C)NC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-10(2)9-11(3)14-12(4)13(16)15-5-7-17-8-6-15/h10-12,14H,5-9H2,1-4H3
InChIKeyQEJQAHJXUYNPNV-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.26
Rot. Bonds5

About 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one

2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one (PubChem CID 43372158) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one
PubChem CID43372158
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one
SMILESCC(C)CC(C)NC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-10(2)9-11(3)14-12(4)13(16)15-5-7-17-8-6-15/h10-12,14H,5-9H2,1-4H3
InChIKeyQEJQAHJXUYNPNV-UHFFFAOYSA-N
XLogP1.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-[[(2S)-hex-5-en-2-yl]amino]-1-morpholin-4-ylpropan-1-one
CID 99628944
2-[(4-hydroxy-3-methylbutan-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 113484800
(2R)-1-morpholin-4-yl-2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]propan-1-one
CID 94159983
[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]carbamic acid
CID 175945134
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
2-[[(1S)-1-cyclopentylethyl]amino]-1-morpholin-4-ylpropan-1-one
CID 81395367
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylpropan-1-one
CID 114174239
(2S)-2-cyclohexyl-4-methyl-1-morpholin-4-ylpentan-1-one
CID 159145676
2-[[(1S)-1-cycloheptylethyl]amino]-1-morpholin-4-ylpropan-1-one
CID 81392361
1-(1-morpholin-4-yl-1-oxopropan-2-yl)-3-propan-2-ylurea
CID 115620431
2-(5-methylhexan-2-ylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 60642296
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
CID 110347736

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one (CID 43372158) is 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one is CC(C)CC(C)NC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The InChIKey is QEJQAHJXUYNPNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)9-11(3)14-12(4)13(16)15-5-7-17-8-6-15/h10-12,14H,5-9H2,1-4H3.
What are the key properties of 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one?
2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one has a molecular weight of 242.36 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpentan-2-ylamino)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 43372158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).