2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine

C11H18N4O — CID 79082098

IUPAC2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine
SMILESCN1CCOC(CNc2ncccc2N)C1
InChIInChI=1S/C11H18N4O/c1-15-5-6-16-9(8-15)7-14-11-10(12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3,(H,13,14)
InChIKeyJZUHHZOIBLQJGU-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.41
Rot. Bonds3

About 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine

2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine (PubChem CID 79082098) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine
PubChem CID79082098
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine
SMILESCN1CCOC(CNc2ncccc2N)C1
InChIInChI=1S/C11H18N4O/c1-15-5-6-16-9(8-15)7-14-11-10(12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3,(H,13,14)
InChIKeyJZUHHZOIBLQJGU-UHFFFAOYSA-N
XLogP0.41
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-methylmorpholin-2-yl)methyl]-3-piperidin-1-ylsulfonylpyridin-2-amine
CID 127297981
6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine
CID 80922854
7-methoxy-N-[(4-methylmorpholin-2-yl)methyl]isoquinolin-1-amine
CID 106539026
3-[(4-methylmorpholin-2-yl)methylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 79072318
2-[(4-ethylmorpholin-2-yl)methylamino]pyridine-3-carboxamide
CID 115619041
8-bromo-N-[[(2S)-4-methylmorpholin-2-yl]methyl]quinazolin-4-amine
CID 95160600
2-amino-5-[(4-methylmorpholin-2-yl)methylamino]benzamide
CID 79071800
5-fluoro-N-[[(2S)-4-methylmorpholin-2-yl]methyl]pyrimidin-2-amine
CID 124594370
5-N-[(4-methylmorpholin-2-yl)methyl]-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103359116
N-[(4-methylmorpholin-2-yl)methyl]-1,2,4-benzotriazin-3-amine
CID 103204381
6-bromo-N-[(4-methylmorpholin-2-yl)methyl]pyridin-2-amine
CID 79070964
4-[(4-methylmorpholin-2-yl)methylamino]pyridine-3-carboxamide
CID 133443007

Frequently Asked Questions

What is the IUPAC name of 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine?
The IUPAC name of 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine (CID 79082098) is 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine.
What is the SMILES notation for 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine?
The canonical SMILES for 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine is CN1CCOC(CNc2ncccc2N)C1.
What is the InChIKey of 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine?
The InChIKey is JZUHHZOIBLQJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-15-5-6-16-9(8-15)7-14-11-10(12)3-2-4-13-11/h2-4,9H,5-8,12H2,1H3,(H,13,14).
What are the key properties of 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine?
2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine has a molecular weight of 222.29 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(4-methylmorpholin-2-yl)methyl]pyridine-2,3-diamine is sourced from PubChem (CID 79082098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).