N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine

C12H26N2O2 — CID 103069655

IUPACN'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine
SMILESC=C(CNCC)CN(CCOC)CCOC
InChIInChI=1S/C12H26N2O2/c1-5-13-10-12(2)11-14(6-8-15-3)7-9-16-4/h13H,2,5-11H2,1,3-4H3
InChIKeyBWDSYVNJBMFKQH-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.75
Rot. Bonds11

About N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine

N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine (PubChem CID 103069655) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine
PubChem CID103069655
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine
SMILESC=C(CNCC)CN(CCOC)CCOC
InChIInChI=1S/C12H26N2O2/c1-5-13-10-12(2)11-14(6-8-15-3)7-9-16-4/h13H,2,5-11H2,1,3-4H3
InChIKeyBWDSYVNJBMFKQH-UHFFFAOYSA-N
XLogP0.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-(2-methoxyethyl)-2-methylprop-2-en-1-amine
CID 57257631
N-(2-ethoxyethyl)-2-methylprop-2-en-1-amine
CID 60061045
2-methyl-N-(2-propan-2-yloxyethyl)prop-2-en-1-amine
CID 104760084
2-Methoxy-3-(3-methyl-2,5-dihydropyrrol-1-yl)propan-1-amine
CID 123192097
N,N'-bis(2-ethenoxyethyl)-2-methylidenepropane-1,3-diamine
CID 129257616
N'-(3-methoxypropyl)-N,N'-dimethylpropane-1,3-diamine;2-methylprop-1-ene;molecular hydrogen
CID 145385314
Dilithium bis(2-methanidylprop-2-enyl-bis(2-methoxyethyl)azanium)
CID 50932750
2-methyl-N-(3-morpholin-4-ylpropyl)prop-2-en-1-amine
CID 60684443
N-(1-methoxypropan-2-yl)-2-methylprop-2-en-1-amine
CID 60688533
N-ethyl-2-methyl-N-(morpholin-2-ylmethyl)prop-2-en-1-amine
CID 61739905

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine?
The IUPAC name of N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine (CID 103069655) is N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine?
The canonical SMILES for N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine is C=C(CNCC)CN(CCOC)CCOC.
What is the InChIKey of N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine?
The InChIKey is BWDSYVNJBMFKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-13-10-12(2)11-14(6-8-15-3)7-9-16-4/h13H,2,5-11H2,1,3-4H3.
What are the key properties of N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine?
N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine has a molecular weight of 230.35 g/mol, XLogP of 0.75, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N,N-bis(2-methoxyethyl)-2-methylidenepropane-1,3-diamine is sourced from PubChem (CID 103069655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).