3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine

C12H20N4O — CID 79092957

IUPAC3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine
SMILESCNC(c1cnccc1N)C1CN(C)CCO1
InChIInChI=1S/C12H20N4O/c1-14-12(9-7-15-4-3-10(9)13)11-8-16(2)5-6-17-11/h3-4,7,11-12,14H,5-6,8H2,1-2H3,(H2,13,15)
InChIKeyKGWBSHVKDWJPDJ-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.25
Rot. Bonds3

About 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine

3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine (PubChem CID 79092957) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine
PubChem CID79092957
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine
SMILESCNC(c1cnccc1N)C1CN(C)CCO1
InChIInChI=1S/C12H20N4O/c1-14-12(9-7-15-4-3-10(9)13)11-8-16(2)5-6-17-11/h3-4,7,11-12,14H,5-6,8H2,1-2H3,(H2,13,15)
InChIKeyKGWBSHVKDWJPDJ-UHFFFAOYSA-N
XLogP0.25
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-2-amine
CID 79093449
(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708320
N-methyl-1-(4-methylmorpholin-2-yl)-1-quinolin-5-ylmethanamine
CID 81231144
3-[(4-propan-2-ylmorpholin-2-yl)-(propylamino)methyl]pyridin-4-amine
CID 79662633
1-(2-ethylpyrazol-3-yl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79092954
3-[amino-(4-propylmorpholin-2-yl)methyl]pyridin-4-amine
CID 79657694
1-(5-bromo-2-fluorophenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79739614
(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanol
CID 102707853
1-(2,5-dimethoxyphenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79092776
N-methyl-1-(4-methylmorpholin-2-yl)-1-[2-(trifluoromethoxy)phenyl]methanamine
CID 79094970
[(4-methylmorpholin-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105244278
1-(3,4-dimethylphenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79093840

Frequently Asked Questions

What is the IUPAC name of 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine?
The IUPAC name of 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine (CID 79092957) is 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine.
What is the SMILES notation for 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine?
The canonical SMILES for 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine is CNC(c1cnccc1N)C1CN(C)CCO1.
What is the InChIKey of 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine?
The InChIKey is KGWBSHVKDWJPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-14-12(9-7-15-4-3-10(9)13)11-8-16(2)5-6-17-11/h3-4,7,11-12,14H,5-6,8H2,1-2H3,(H2,13,15).
What are the key properties of 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine?
3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methylamino-(4-methylmorpholin-2-yl)methyl]pyridin-4-amine is sourced from PubChem (CID 79092957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).