N,N'-dimethyl-N-morpholin-4-ylmethanimidamide

C7H15N3O — CID 45088514

IUPACN,N'-dimethyl-N-morpholin-4-ylmethanimidamide
SMILESC/N=C/N(C)N1CCOCC1
InChIInChI=1S/C7H15N3O/c1-8-7-9(2)10-3-5-11-6-4-10/h7H,3-6H2,1-2H3/b8-7+
InChIKeyGHTWIIDSESMMHJ-BQYQJAHWSA-N
MW157.22 g/mol
LogP-0.18
Rot. Bonds2

About N,N'-dimethyl-N-morpholin-4-ylmethanimidamide

N,N'-dimethyl-N-morpholin-4-ylmethanimidamide (PubChem CID 45088514) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is N,N'-dimethyl-N-morpholin-4-ylmethanimidamide.

Molecular Properties

Compound NameN,N'-dimethyl-N-morpholin-4-ylmethanimidamide
PubChem CID45088514
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC NameN,N'-dimethyl-N-morpholin-4-ylmethanimidamide
SMILESC/N=C/N(C)N1CCOCC1
InChIInChI=1S/C7H15N3O/c1-8-7-9(2)10-3-5-11-6-4-10/h7H,3-6H2,1-2H3/b8-7+
InChIKeyGHTWIIDSESMMHJ-BQYQJAHWSA-N
XLogP-0.18
TPSA28.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
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 N,N'-dimethyl-N-morpholin-4-ylmethanimidamide?
The IUPAC name of N,N'-dimethyl-N-morpholin-4-ylmethanimidamide (CID 45088514) is N,N'-dimethyl-N-morpholin-4-ylmethanimidamide.
What is the SMILES notation for N,N'-dimethyl-N-morpholin-4-ylmethanimidamide?
The canonical SMILES for N,N'-dimethyl-N-morpholin-4-ylmethanimidamide is C/N=C/N(C)N1CCOCC1.
What is the InChIKey of N,N'-dimethyl-N-morpholin-4-ylmethanimidamide?
The InChIKey is GHTWIIDSESMMHJ-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H15N3O/c1-8-7-9(2)10-3-5-11-6-4-10/h7H,3-6H2,1-2H3/b8-7+.
What are the key properties of N,N'-dimethyl-N-morpholin-4-ylmethanimidamide?
N,N'-dimethyl-N-morpholin-4-ylmethanimidamide has a molecular weight of 157.22 g/mol, XLogP of -0.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N-morpholin-4-ylmethanimidamide is sourced from PubChem (CID 45088514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).