3-(2-methylmorpholin-4-yl)pentanimidamide

C10H21N3O — CID 43367839

IUPAC3-(2-methylmorpholin-4-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCOC(C)C1
InChIInChI=1S/C10H21N3O/c1-3-9(6-10(11)12)13-4-5-14-8(2)7-13/h8-9H,3-7H2,1-2H3,(H3,11,12)
InChIKeyIAMJEBUNWFSPJW-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.81
Rot. Bonds4

About 3-(2-methylmorpholin-4-yl)pentanimidamide

3-(2-methylmorpholin-4-yl)pentanimidamide (PubChem CID 43367839) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-(2-methylmorpholin-4-yl)pentanimidamide.

Molecular Properties

Compound Name3-(2-methylmorpholin-4-yl)pentanimidamide
PubChem CID43367839
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-(2-methylmorpholin-4-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCOC(C)C1
InChIInChI=1S/C10H21N3O/c1-3-9(6-10(11)12)13-4-5-14-8(2)7-13/h8-9H,3-7H2,1-2H3,(H3,11,12)
InChIKeyIAMJEBUNWFSPJW-UHFFFAOYSA-N
XLogP0.81
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylmorpholin-4-yl)pentanimidamide?
The IUPAC name of 3-(2-methylmorpholin-4-yl)pentanimidamide (CID 43367839) is 3-(2-methylmorpholin-4-yl)pentanimidamide.
What is the SMILES notation for 3-(2-methylmorpholin-4-yl)pentanimidamide?
The canonical SMILES for 3-(2-methylmorpholin-4-yl)pentanimidamide is [H]/N=C(\N)CC(CC)N1CCOC(C)C1.
What is the InChIKey of 3-(2-methylmorpholin-4-yl)pentanimidamide?
The InChIKey is IAMJEBUNWFSPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-9(6-10(11)12)13-4-5-14-8(2)7-13/h8-9H,3-7H2,1-2H3,(H3,11,12).
What are the key properties of 3-(2-methylmorpholin-4-yl)pentanimidamide?
3-(2-methylmorpholin-4-yl)pentanimidamide has a molecular weight of 199.30 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylmorpholin-4-yl)pentanimidamide is sourced from PubChem (CID 43367839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).