N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine

C7H16AlN — CID 175141880

IUPACN-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine
SMILESC=CC([AlH2])NC(C)(C)C
InChIInChI=1S/C7H14N.Al.2H/c1-5-6-8-7(2,3)4;;;/h5-6,8H,1H2,2-4H3;;;
InChIKeyAMSUYLHDRZVNDC-UHFFFAOYSA-N
MW141.19 g/mol
LogP0.52
Rot. Bonds2

About N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine

N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine (PubChem CID 175141880) has the molecular formula C7H16AlN and a molecular weight of 141.19 g/mol. Its IUPAC name is N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine
PubChem CID175141880
Molecular FormulaC7H16AlN
Molecular Weight141.19 g/mol
Exact Mass141.11
IUPAC NameN-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine
SMILESC=CC([AlH2])NC(C)(C)C
InChIInChI=1S/C7H14N.Al.2H/c1-5-6-8-7(2,3)4;;;/h5-6,8H,1H2,2-4H3;;;
InChIKeyAMSUYLHDRZVNDC-UHFFFAOYSA-N
XLogP0.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.19
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,1-N'-ditert-butylethane-1,1-diamine
CID 23031273
2-tert-butyl-N-methylbut-3-en-1-amine
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N-tert-butyl-2,2,4,4-tetramethylpentan-3-amine
CID 84669079
3-tert-butylpenta-1,4-diene
CID 12556609
ethene;bis(2,2,5,5-tetramethylhex-3-ene)
CID 162279391
2-(but-3-en-2-ylamino)-2-methylpropane-1,3-diol
CID 107907644
methyl 2-amino-3,3-dimethylpent-4-enoate
CID 22592920
2-(but-3-en-2-ylamino)-2-methylpropanamide
CID 107906717
2-(tert-butylamino)-1-methoxyimino-4,4-dimethylpentan-3-one
CID 59446093
2,6-dimethyloct-7-en-2-yloxymethanethiol
CID 57007334
1-N,1-N'-ditert-butylpropane-1,1-diamine
CID 134169059
1-(tert-butylamino)-2-methylpropan-1-ol
CID 23232997

Frequently Asked Questions

What is the IUPAC name of N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine?
The IUPAC name of N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine (CID 175141880) is N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine.
What is the SMILES notation for N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine?
The canonical SMILES for N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine is C=CC([AlH2])NC(C)(C)C.
What is the InChIKey of N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine?
The InChIKey is AMSUYLHDRZVNDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N.Al.2H/c1-5-6-8-7(2,3)4;;;/h5-6,8H,1H2,2-4H3;;;.
What are the key properties of N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine?
N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine has a molecular weight of 141.19 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-alumanylprop-2-enyl)-2-methylpropan-2-amine is sourced from PubChem (CID 175141880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).