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

C13H27N3O — CID 114132993

IUPACN'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
SMILESCCN(CCNCCN1CCOCC1)C1CC1
InChIInChI=1S/C13H27N3O/c1-2-16(13-3-4-13)8-6-14-5-7-15-9-11-17-12-10-15/h13-14H,2-12H2,1H3
InChIKeyFNHWBMDMEWVTJC-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.39
Rot. Bonds8

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

N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine (PubChem CID 114132993) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
PubChem CID114132993
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
SMILESCCN(CCNCCN1CCOCC1)C1CC1
InChIInChI=1S/C13H27N3O/c1-2-16(13-3-4-13)8-6-14-5-7-15-9-11-17-12-10-15/h13-14H,2-12H2,1H3
InChIKeyFNHWBMDMEWVTJC-UHFFFAOYSA-N
XLogP0.39
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.39
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'-methyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine
CID 62977611
N-ethyl-N-(2-morpholin-4-ylethyl)oxetan-3-amine
CID 130358984
2-N-cyclopropyl-2-N-methyl-1-N-(2-morpholin-4-ylethyl)propane-1,2-diamine
CID 114133400
N',N'-dimethyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28583738
N-[2-[3-(diethylamino)pyrrolidin-1-yl]ethyl]-N',N'-diethylethane-1,2-diamine
CID 63167488
N'-cyclopropyl-N-(2-ethoxyethyl)-N'-ethylethane-1,2-diamine
CID 62559981
CID 59303713
CID 59303713
N-(1,1-dioxothiolan-3-yl)-N-ethyl-3-(2-morpholin-4-ylethylamino)propanamide
CID 109016730
N',N'-dimethyl-N-[2-(3-morpholin-4-ylpyrrolidin-1-yl)ethyl]ethane-1,2-diamine
CID 63168286
1-[2-[cyclopropyl(ethyl)amino]ethyl]-2-methyl-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]guanidine;hydroiodide
CID 111374836
1-[2-[2-[cyclopropyl(ethyl)amino]ethylamino]ethyl]triazole-4-carboxylic acid
CID 114133017
2-(2-morpholin-4-ylethylamino)acetonitrile
CID 28583059

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine (CID 114132993) is N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine is CCN(CCNCCN1CCOCC1)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
The InChIKey is FNHWBMDMEWVTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-2-16(13-3-4-13)8-6-14-5-7-15-9-11-17-12-10-15/h13-14H,2-12H2,1H3.
What are the key properties of N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine?
N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine has a molecular weight of 241.38 g/mol, XLogP of 0.39, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-ethyl-N-(2-morpholin-4-ylethyl)ethane-1,2-diamine is sourced from PubChem (CID 114132993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).