N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine

C12H25N3O — CID 62977611

IUPACN'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
SMILESCN(CCNCCN1CCOCC1)C1CC1
InChIInChI=1S/C12H25N3O/c1-14(12-2-3-12)6-4-13-5-7-15-8-10-16-11-9-15/h12-13H,2-11H2,1H3
InChIKeyXXFJBFVHDHQAFJ-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.00
Rot. Bonds7

About N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine

N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine (PubChem CID 62977611) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
PubChem CID62977611
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
SMILESCN(CCNCCN1CCOCC1)C1CC1
InChIInChI=1S/C12H25N3O/c1-14(12-2-3-12)6-4-13-5-7-15-8-10-16-11-9-15/h12-13H,2-11H2,1H3
InChIKeyXXFJBFVHDHQAFJ-UHFFFAOYSA-N
XLogP0.00
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
CID 114132993
N',N'-dimethyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28583738
2-N-cyclopropyl-2-N-methyl-1-N-(2-morpholin-4-ylethyl)propane-1,2-diamine
CID 114133400
4-[methyl(2-morpholin-4-ylethyl)amino]cyclohexan-1-one
CID 79120517
N,1-dimethyl-N-(2-morpholin-4-ylethyl)pyrrolidin-3-amine
CID 145256619
N'-methyl-N'-(oxan-4-yl)-N-pentylethane-1,2-diamine
CID 62560454
N',N'-dimethyl-N-[2-(3-morpholin-4-ylpyrrolidin-1-yl)ethyl]ethane-1,2-diamine
CID 63168286
CID 59303713
CID 59303713
1-[2-[cyclopentyl(methyl)amino]ethyl]-2-(3-morpholin-4-ylpropyl)guanidine;hydroiodide
CID 111804104
N'-cyclopropyl-N'-methyl-N-[(4-methylmorpholin-2-yl)methyl]ethane-1,2-diamine
CID 79172100
1,1-dimethyl-3-[2-(2-morpholin-4-ylethylamino)ethyl]urea
CID 83120439
N'-benzyl-N'-methyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28577606

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine (CID 62977611) is N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine is CN(CCNCCN1CCOCC1)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The InChIKey is XXFJBFVHDHQAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-14(12-2-3-12)6-4-13-5-7-15-8-10-16-11-9-15/h12-13H,2-11H2,1H3.
What are the key properties of N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine has a molecular weight of 227.35 g/mol, XLogP of 0.00, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine is sourced from PubChem (CID 62977611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).