2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine

C12H24N2O — CID 66047361

IUPAC2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
SMILESC=C(CC)CNC(C)CN1CCOCC1
InChIInChI=1S/C12H24N2O/c1-4-11(2)9-13-12(3)10-14-5-7-15-8-6-14/h12-13H,2,4-10H2,1,3H3
InChIKeySQULRICADXAVBM-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.26
Rot. Bonds6

About 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine

2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine (PubChem CID 66047361) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine.

Molecular Properties

Compound Name2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
PubChem CID66047361
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
SMILESC=C(CC)CNC(C)CN1CCOCC1
InChIInChI=1S/C12H24N2O/c1-4-11(2)9-13-12(3)10-14-5-7-15-8-6-14/h12-13H,2,4-10H2,1,3H3
InChIKeySQULRICADXAVBM-UHFFFAOYSA-N
XLogP1.26
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 ≤ 51.26
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

2-methyl-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675679
(2R)-1-(1-morpholin-4-ylpropan-2-ylamino)propan-2-ol
CID 106931969
3-methyl-N-(1-morpholin-4-ylpropan-2-yl)but-2-en-1-amine
CID 106546980
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
2-(morpholin-4-ylmethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103068808
N-[2-(1-morpholin-4-ylpropan-2-ylamino)ethyl]acetamide
CID 107529281
N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
CID 80694695
N-butan-2-yl-2-methyl-3-morpholin-4-ylpropan-1-amine
CID 115722394
1-(1,4-oxazepan-4-yl)-N-propylpropan-2-amine
CID 62988157
N-(3-fluoropropyl)-1-morpholin-4-ylpropan-2-amine
CID 81105734
N-(2,2-dimethoxyethyl)-1-morpholin-4-ylpropan-2-amine
CID 63684989
3-methyl-1-morpholin-4-ylbut-3-en-2-ol
CID 13415301

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine?
The IUPAC name of 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine (CID 66047361) is 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine.
What is the SMILES notation for 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine?
The canonical SMILES for 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine is C=C(CC)CNC(C)CN1CCOCC1.
What is the InChIKey of 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine?
The InChIKey is SQULRICADXAVBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-11(2)9-13-12(3)10-14-5-7-15-8-6-14/h12-13H,2,4-10H2,1,3H3.
What are the key properties of 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine?
2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine has a molecular weight of 212.34 g/mol, XLogP of 1.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine is sourced from PubChem (CID 66047361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).