(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine

C12H26N2O — CID 97045041

IUPAC(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine
SMILESCC(C)C[C@H](C)NC[C@H]1CN(C)CCO1
InChIInChI=1S/C12H26N2O/c1-10(2)7-11(3)13-8-12-9-14(4)5-6-15-12/h10-13H,5-9H2,1-4H3/t11-,12-/m0/s1
InChIKeyJKLGJJYCKQVJML-RYUDHWBXSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds5

About (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine

(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine (PubChem CID 97045041) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine.

Molecular Properties

Compound Name(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine
PubChem CID97045041
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine
SMILESCC(C)C[C@H](C)NC[C@H]1CN(C)CCO1
InChIInChI=1S/C12H26N2O/c1-10(2)7-11(3)13-8-12-9-14(4)5-6-15-12/h10-13H,5-9H2,1-4H3/t11-,12-/m0/s1
InChIKeyJKLGJJYCKQVJML-RYUDHWBXSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine with MolForge

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Related Compounds

4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356159
2-[(4-methylmorpholin-2-yl)methylamino]propan-1-ol
CID 78945058
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
(1S)-1-cyclopropyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 97045036
N-methyl-3-[(4-methylmorpholin-2-yl)methylamino]butanamide
CID 115889192
3-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356168
2-[(4-methylmorpholin-2-yl)methylamino]propanoic acid
CID 78967405
(1S)-1-cyclohexyl-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 81384591
2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945177
N-methyl-2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945377
4-methyl-2-(3-methylbutyl)morpholine
CID 59613546
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973

Frequently Asked Questions

What is the IUPAC name of (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine?
The IUPAC name of (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine (CID 97045041) is (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine.
What is the SMILES notation for (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine?
The canonical SMILES for (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine is CC(C)C[C@H](C)NC[C@H]1CN(C)CCO1.
What is the InChIKey of (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine?
The InChIKey is JKLGJJYCKQVJML-RYUDHWBXSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10(2)7-11(3)13-8-12-9-14(4)5-6-15-12/h10-13H,5-9H2,1-4H3/t11-,12-/m0/s1.
What are the key properties of (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine?
(2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pentan-2-amine is sourced from PubChem (CID 97045041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).