1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine

C11H26AlNO — CID 139905355

IUPAC1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)C(CC)O[Al](C)C
InChIInChI=1S/C9H20NO.2CH3.Al/c1-4-7-10(8-5-2)9(11)6-3;;;/h9H,4-8H2,1-3H3;2*1H3;/q-1;;;+1
InChIKeyCYUPRJWGBRMBCH-UHFFFAOYSA-N
MW215.32 g/mol
LogP3.11
Rot. Bonds8

About 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine

1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine (PubChem CID 139905355) has the molecular formula C11H26AlNO and a molecular weight of 215.32 g/mol. Its IUPAC name is 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine
PubChem CID139905355
Molecular FormulaC11H26AlNO
Molecular Weight215.32 g/mol
Exact Mass215.18
IUPAC Name1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)C(CC)O[Al](C)C
InChIInChI=1S/C9H20NO.2CH3.Al/c1-4-7-10(8-5-2)9(11)6-3;;;/h9H,4-8H2,1-3H3;2*1H3;/q-1;;;+1
InChIKeyCYUPRJWGBRMBCH-UHFFFAOYSA-N
XLogP3.11
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-dimethylalumanyloxy-N,N-dimethylpropan-1-amine
CID 139905114
1-dipropylalumanyloxy-N,N-dipropylbutan-1-amine
CID 139905287
N,N-dipropylbutan-2-amine
CID 524229
N,N-dipropylbutan-2-amine;ethane;propane
CID 143577846
1-dioctylalumanyloxy-N,N-diethylpropan-1-amine
CID 139905004
1-dihexylalumanyloxy-N,N-diethylpropan-1-amine
CID 139905384
1-N,1-N,1-N',1-N'-tetrapropylethane-1,1-diamine
CID 141222296
N-[1-[bis(2-methylpropyl)alumanyloxy]ethyl]-N-propylpropan-1-amine
CID 139905319
[butan-2-yl(propyl)amino]methanethiol
CID 142982154
N,N,N',N'-tetrapropyl-1-silylmethanediamine
CID 174173151
4-methyl-3-propan-2-yl-2-N,2-N-dipropylpentane-1,2-diamine
CID 114281886
1-(dipropylamino)propyl 4-fluorobenzoate;hydrochloride
CID 23616853

Frequently Asked Questions

What is the IUPAC name of 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine?
The IUPAC name of 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine (CID 139905355) is 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine?
The canonical SMILES for 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine is CCCN(CCC)C(CC)O[Al](C)C.
What is the InChIKey of 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine?
The InChIKey is CYUPRJWGBRMBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20NO.2CH3.Al/c1-4-7-10(8-5-2)9(11)6-3;;;/h9H,4-8H2,1-3H3;2*1H3;/q-1;;;+1.
What are the key properties of 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine?
1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine has a molecular weight of 215.32 g/mol, XLogP of 3.11, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dimethylalumanyloxy-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 139905355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).