N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine

C16H27N3O — CID 62283828

IUPACN-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCc1cc(N2CCOC(C)(C)C2)ccn1
InChIInChI=1S/C16H27N3O/c1-13(2)10-17-11-14-9-15(5-6-18-14)19-7-8-20-16(3,4)12-19/h5-6,9,13,17H,7-8,10-12H2,1-4H3
InChIKeyJLXWJWJAIXOERB-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.44
Rot. Bonds5

About N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine

N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine (PubChem CID 62283828) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
PubChem CID62283828
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCc1cc(N2CCOC(C)(C)C2)ccn1
InChIInChI=1S/C16H27N3O/c1-13(2)10-17-11-14-9-15(5-6-18-14)19-7-8-20-16(3,4)12-19/h5-6,9,13,17H,7-8,10-12H2,1-4H3
InChIKeyJLXWJWJAIXOERB-UHFFFAOYSA-N
XLogP2.44
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2-pyridinyl]methyl]propan-1-amine
CID 66371985
N-[[6-(2,2-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62281742
N-[[2-(2,2-dimethylmorpholin-4-yl)-1,3-thiazol-5-yl]methyl]-2-methylpropan-1-amine
CID 62751980
4-(2,2-dimethylmorpholin-4-yl)pyridine-2-carboxamide
CID 133313842
N-[[5-(2,2-dimethylmorpholin-4-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-1-amine
CID 106969407
N-[[2-(2,2-dimethylmorpholin-4-yl)-4-pyridinyl]methyl]ethanamine
CID 62282782
2-methyl-N-[[4-(2,3,5-trimethylpiperidin-1-yl)-2-pyridinyl]methyl]propan-1-amine
CID 114596902
N-[[3-[(2,2-dimethylmorpholin-4-yl)methyl]furan-2-yl]methyl]-2-methylpropan-1-amine
CID 62433499
N-[[4-(azocan-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62281231
N-[[4-(2-methylmorpholin-4-yl)-2-pyridinyl]methyl]propan-2-amine
CID 55054705
2,2-dimethyl-4-phenylmorpholine
CID 15576765
2-methyl-N-[[4-(2,2,6-trimethylmorpholin-4-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62293949

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine (CID 62283828) is N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine is CC(C)CNCc1cc(N2CCOC(C)(C)C2)ccn1.
What is the InChIKey of N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
The InChIKey is JLXWJWJAIXOERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-13(2)10-17-11-14-9-15(5-6-18-14)19-7-8-20-16(3,4)12-19/h5-6,9,13,17H,7-8,10-12H2,1-4H3.
What are the key properties of N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine?
N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine has a molecular weight of 277.41 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2,2-dimethylmorpholin-4-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 62283828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).