2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one

C13H26N2O2 — CID 113352721

IUPAC2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one
SMILESCCCC(C)CNC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-4-5-11(2)10-14-12(3)13(16)15-6-8-17-9-7-15/h11-12,14H,4-10H2,1-3H3
InChIKeyKFWQTKCPJVNTLM-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.26
Rot. Bonds6

About 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one

2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one (PubChem CID 113352721) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one
PubChem CID113352721
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one
SMILESCCCC(C)CNC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-4-5-11(2)10-14-12(3)13(16)15-6-8-17-9-7-15/h11-12,14H,4-10H2,1-3H3
InChIKeyKFWQTKCPJVNTLM-UHFFFAOYSA-N
XLogP1.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

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Related Compounds

N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
CID 110347736
2-(3-methylsulfonylpropylamino)-1-morpholin-4-ylpropan-1-one
CID 54905141
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylpropan-1-one
CID 114174239
2-(6-hydroxyhexylamino)-1-morpholin-4-ylpropan-1-one
CID 107703595
2-[2-(tert-butylamino)ethylamino]-1-morpholin-4-ylpropan-1-one
CID 107446064
N,N-diethyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanamide
CID 115588983
1-ethyl-3-(1-morpholin-4-yl-1-oxopropan-2-yl)urea
CID 116657745
2-hydroxy-2-methyl-3-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]propanoic acid
CID 104645019
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
1-morpholin-4-yl-2-propylhexan-1-one
CID 146231854
1,1-diethyl-3-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]urea
CID 110347785
2-[(1-methylsulfanylcyclopropyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 107266231

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one (CID 113352721) is 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one is CCCC(C)CNC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one?
The InChIKey is KFWQTKCPJVNTLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-5-11(2)10-14-12(3)13(16)15-6-8-17-9-7-15/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one?
2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one has a molecular weight of 242.36 g/mol, XLogP of 1.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpentylamino)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 113352721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).