(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine

C12H26N2O — CID 97045047

IUPAC(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine
SMILESCCC[C@H](C)CNC[C@@H]1CN(C)CCO1
InChIInChI=1S/C12H26N2O/c1-4-5-11(2)8-13-9-12-10-14(3)6-7-15-12/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1
InChIKeyUHWJFNNKSBEBFM-NWDGAFQWSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds6

About (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine

(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine (PubChem CID 97045047) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine.

Molecular Properties

Compound Name(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine
PubChem CID97045047
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine
SMILESCCC[C@H](C)CNC[C@@H]1CN(C)CCO1
InChIInChI=1S/C12H26N2O/c1-4-5-11(2)8-13-9-12-10-14(3)6-7-15-12/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1
InChIKeyUHWJFNNKSBEBFM-NWDGAFQWSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine with MolForge

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Related Compounds

2-methyl-N-[(4-methylmorpholin-2-yl)methyl]butan-1-amine
CID 75356165
2-ethyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]butan-1-amine
CID 97045075
2,2-dicyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]ethanamine
CID 79172002
(2R)-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]pentan-1-amine
CID 28619216
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
1-[(4-methylmorpholin-2-yl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 78945365
3-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356168
methyl 2-bromo-3-[(4-methylmorpholin-2-yl)methylamino]propanoate
CID 103255442
N-[[(2S)-4-methylmorpholin-2-yl]methyl]-1-[(2R)-oxan-2-yl]methanamine
CID 129432103
2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide
CID 78945295
1-[(4-methylmorpholin-2-yl)methylamino]-3-(4-methylpentoxy)propan-2-ol
CID 78945233
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pentan-2-amine
CID 75356159

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine?
The IUPAC name of (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine (CID 97045047) is (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine.
What is the SMILES notation for (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine?
The canonical SMILES for (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine is CCC[C@H](C)CNC[C@@H]1CN(C)CCO1.
What is the InChIKey of (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine?
The InChIKey is UHWJFNNKSBEBFM-NWDGAFQWSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-5-11(2)8-13-9-12-10-14(3)6-7-15-12/h11-13H,4-10H2,1-3H3/t11-,12+/m0/s1.
What are the key properties of (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine?
(2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pentan-1-amine is sourced from PubChem (CID 97045047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).