N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine

C12H24N2O — CID 60867675

IUPACN-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
SMILESCCC1COCCN1CCCNC1CC1
InChIInChI=1S/C12H24N2O/c1-2-12-10-15-9-8-14(12)7-3-6-13-11-4-5-11/h11-13H,2-10H2,1H3
InChIKeyDYIBWTLXHNALDG-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds6

About N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine

N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine (PubChem CID 60867675) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
PubChem CID60867675
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
SMILESCCC1COCCN1CCCNC1CC1
InChIInChI=1S/C12H24N2O/c1-2-12-10-15-9-8-14(12)7-3-6-13-11-4-5-11/h11-13H,2-10H2,1H3
InChIKeyDYIBWTLXHNALDG-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Isobutyl-(3-morpholin-4-yl-propyl)-amine
CID 3151942
Butyl-(3-morpholin-4-yl-propyl)-amine
CID 3151943
N-(2-Methoxyethyl)-1-methylpiperidin-4-amine
CID 2761027
4-(Morpholin-4-yl)butan-2-amine
CID 16767299
3-(Morpholin-4-yl)butan-1-amine
CID 20069556
rac-(2R,6S)-1-(2-methoxyethyl)-2,6-dimethylpiperazine
CID 51623023
Methyl(2-(morpholin-3-yl)ethyl)amine
CID 53849357
Methyl[1-(morpholin-4-yl)propan-2-yl]amine
CID 61501008
1-ethyl-N-(2-methoxyethyl)piperidin-4-amine
CID 2247136
3-(Morpholin-4-yl)butan-2-amine
CID 50987517
1-(2-Ethoxyethyl)-2-ethylpiperazine
CID 54592596
4-(Morpholin-4-yl)butan-2-amine dihydrochloride
CID 54593056

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The IUPAC name of N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine (CID 60867675) is N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine is CCC1COCCN1CCCNC1CC1.
What is the InChIKey of N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
The InChIKey is DYIBWTLXHNALDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-2-12-10-15-9-8-14(12)7-3-6-13-11-4-5-11/h11-13H,2-10H2,1H3.
What are the key properties of N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine?
N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine is sourced from PubChem (CID 60867675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).