2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide

C15H30N2O2 — CID 166016856

IUPAC2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide
SMILESCC(C)CCCN1CCO[C@@H](CNC(=O)C(C)C)C1
InChIInChI=1S/C15H30N2O2/c1-12(2)6-5-7-17-8-9-19-14(11-17)10-16-15(18)13(3)4/h12-14H,5-11H2,1-4H3,(H,16,18)/t14-/m0/s1
InChIKeyWCYRISLIJUBCFJ-AWEZNQCLSA-N
MW270.42 g/mol
LogP1.90
Rot. Bonds7

About 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide

2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide (PubChem CID 166016856) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide
PubChem CID166016856
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide
SMILESCC(C)CCCN1CCO[C@@H](CNC(=O)C(C)C)C1
InChIInChI=1S/C15H30N2O2/c1-12(2)6-5-7-17-8-9-19-14(11-17)10-16-15(18)13(3)4/h12-14H,5-11H2,1-4H3,(H,16,18)/t14-/m0/s1
InChIKeyWCYRISLIJUBCFJ-AWEZNQCLSA-N
XLogP1.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2S)-4-(2-butoxyethyl)morpholin-2-yl]methyl]-2-methylpropanamide
CID 156523761
2-methyl-N-[[(2S)-4-(2-pentoxyethyl)morpholin-2-yl]methyl]propanamide
CID 138727702
N-[[4-[2-(4-aminobutoxy)ethyl]morpholin-2-yl]methyl]-2-methylpropanamide
CID 166118448
ethane;2-methyl-N-[[4-(2-pentoxyethyl)morpholin-2-yl]methyl]propanamide
CID 142616120
2-methyl-N-[[(2R)-4-pentylmorpholin-2-yl]methyl]butanamide
CID 163401131
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
N-[[(2R)-4-[2-(4-methylpentoxy)ethyl]morpholin-2-yl]methyl]acetamide
CID 156802663
2-[4-(4-methylpentyl)morpholin-2-yl]acetic acid
CID 83158040
N,2-dimethyl-N-[[(2R)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide
CID 138727851
(2R)-2,4-bis(4-methylpentyl)morpholine
CID 149421762
N-[[(2R)-4-[2-(4,4-dimethylpentoxy)ethyl]morpholin-2-yl]methyl]-2,5,5-trimethyl-8-[2-[2-[(2-methylpropanoylamino)methyl]morpholin-4-yl]ethoxy]octanamide
CID 170057233
[4-(4-methylpentyl)morpholin-2-yl]methanamine
CID 83157184

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide?
The IUPAC name of 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide (CID 166016856) is 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide?
The canonical SMILES for 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide is CC(C)CCCN1CCO[C@@H](CNC(=O)C(C)C)C1.
What is the InChIKey of 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide?
The InChIKey is WCYRISLIJUBCFJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)6-5-7-17-8-9-19-14(11-17)10-16-15(18)13(3)4/h12-14H,5-11H2,1-4H3,(H,16,18)/t14-/m0/s1.
What are the key properties of 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide?
2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide has a molecular weight of 270.42 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[(2S)-4-(4-methylpentyl)morpholin-2-yl]methyl]propanamide is sourced from PubChem (CID 166016856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).