N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine

C13H24N2O — CID 103068848

IUPACN-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine
SMILESC=C(CNC1CC1)CN1CC(C)OC(C)C1
InChIInChI=1S/C13H24N2O/c1-10(6-14-13-4-5-13)7-15-8-11(2)16-12(3)9-15/h11-14H,1,4-9H2,2-3H3
InChIKeyNAVJMDUXUZCHPI-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.40
Rot. Bonds5

About N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine

N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine (PubChem CID 103068848) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine
PubChem CID103068848
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine
SMILESC=C(CNC1CC1)CN1CC(C)OC(C)C1
InChIInChI=1S/C13H24N2O/c1-10(6-14-13-4-5-13)7-15-8-11(2)16-12(3)9-15/h11-14H,1,4-9H2,2-3H3
InChIKeyNAVJMDUXUZCHPI-UHFFFAOYSA-N
XLogP1.40
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-methyl-N-(3-morpholin-4-ylpropyl)but-2-en-1-amine
CID 20529045
2-methyl-N-(3-morpholin-4-ylpropyl)but-2-en-1-amine
CID 53925762
N-[(4-propan-2-ylmorpholin-2-yl)methyl]cyclopropanamine
CID 64533284
N-[(4-ethylmorpholin-2-yl)methyl]cyclopropanamine
CID 79163975
N-[(4-methylmorpholin-2-yl)methyl]cyclopropanamine
CID 79172378
N-[2-[(2S)-2-(ethylaminomethyl)morpholin-4-yl]ethyl]-N,2-dimethylprop-2-en-1-amine
CID 155189256
N-[[(2S)-4-propan-2-ylmorpholin-2-yl]methyl]cyclopropanamine
CID 156162691
N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]cyclopropanamine
CID 156163769
N-[[(2S)-4-butan-2-ylmorpholin-2-yl]methyl]cyclopropanamine
CID 156167851
N-[[(2R)-4-ethylmorpholin-2-yl]methyl]cyclopropanamine
CID 156168195
ethane;N-[(4-methylmorpholin-2-yl)methyl]cyclopropanamine
CID 156652038
N-[(4-cyclopropylmorpholin-2-yl)methyl]-2-methylpropan-2-amine
CID 157982645

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine?
The IUPAC name of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine (CID 103068848) is N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine.
What is the SMILES notation for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine?
The canonical SMILES for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine is C=C(CNC1CC1)CN1CC(C)OC(C)C1.
What is the InChIKey of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine?
The InChIKey is NAVJMDUXUZCHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10(6-14-13-4-5-13)7-15-8-11(2)16-12(3)9-15/h11-14H,1,4-9H2,2-3H3.
What are the key properties of N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine?
N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine has a molecular weight of 224.35 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2,6-dimethylmorpholin-4-yl)methyl]prop-2-enyl]cyclopropanamine is sourced from PubChem (CID 103068848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).