N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)

C9H27N3 — CID 170750013

IUPACN,2-dimethylpropan-2-amine;bis(N-methylmethanamine)
SMILESCNC.CNC.CNC(C)(C)C
InChIInChI=1S/C5H13N.2C2H7N/c1-5(2,3)6-4;2*1-3-2/h6H,1-4H3;2*3H,1-2H3
InChIKeyBBXOVNUPJZFCME-UHFFFAOYSA-N
MW177.34 g/mol
LogP0.68
Rot. Bonds

About N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)

N,2-dimethylpropan-2-amine;bis(N-methylmethanamine) (PubChem CID 170750013) has the molecular formula C9H27N3 and a molecular weight of 177.34 g/mol. Its IUPAC name is N,2-dimethylpropan-2-amine;bis(N-methylmethanamine).

Molecular Properties

Compound NameN,2-dimethylpropan-2-amine;bis(N-methylmethanamine)
PubChem CID170750013
Molecular FormulaC9H27N3
Molecular Weight177.34 g/mol
Exact Mass177.22
IUPAC NameN,2-dimethylpropan-2-amine;bis(N-methylmethanamine)
SMILESCNC.CNC.CNC(C)(C)C
InChIInChI=1S/C5H13N.2C2H7N/c1-5(2,3)6-4;2*1-3-2/h6H,1-4H3;2*3H,1-2H3
InChIKeyBBXOVNUPJZFCME-UHFFFAOYSA-N
XLogP0.68
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.34
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-Di-tert-butylethylenediamine
CID 77680
N-Methyl-tert-butylamine
CID 84552
N,N'-Di-t-butyl-trimethylenediamine
CID 469925
Dibutadiamine
CID 15853
Diethylenetriamine, 1,7-bis(t-butyl)-
CID 87746757
Tert-butyl(dimethyl)azanium
CID 6993921
Tert-butyl(methyl)azanium
CID 6995482
Bis(t-butylamino)acetylene
CID 6396780
N,2-Dimethylpropan-2-amine--hydrogen chloride (1/1)
CID 24196490
N,N'-ditert-butylhexa-2,4-diyne-1,6-diamine
CID 134995406
Bis(tertbutylimino)bis(dimethylamino)tungsten(IV)
CID 135563859
Tert-butyl-[2-(tert-butylamino)ethyl]azanium
CID 178337189

Frequently Asked Questions

What is the IUPAC name of N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)?
The IUPAC name of N,2-dimethylpropan-2-amine;bis(N-methylmethanamine) (CID 170750013) is N,2-dimethylpropan-2-amine;bis(N-methylmethanamine).
What is the SMILES notation for N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)?
The canonical SMILES for N,2-dimethylpropan-2-amine;bis(N-methylmethanamine) is CNC.CNC.CNC(C)(C)C.
What is the InChIKey of N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)?
The InChIKey is BBXOVNUPJZFCME-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.2C2H7N/c1-5(2,3)6-4;2*1-3-2/h6H,1-4H3;2*3H,1-2H3.
What are the key properties of N,2-dimethylpropan-2-amine;bis(N-methylmethanamine)?
N,2-dimethylpropan-2-amine;bis(N-methylmethanamine) has a molecular weight of 177.34 g/mol, XLogP of 0.68, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylpropan-2-amine;bis(N-methylmethanamine) is sourced from PubChem (CID 170750013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).