cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine

C12H29N3 — CID 162293732

IUPACcyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine
SMILESC1CCCC1.CNCC(N(C)C)N(C)C
InChIInChI=1S/C7H19N3.C5H10/c1-8-6-7(9(2)3)10(4)5;1-2-4-5-3-1/h7-8H,6H2,1-5H3;1-5H2
InChIKeyRTRJQWYTUDJGFM-UHFFFAOYSA-N
MW215.38 g/mol
LogP1.61
Rot. Bonds4

About cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine

cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine (PubChem CID 162293732) has the molecular formula C12H29N3 and a molecular weight of 215.38 g/mol. Its IUPAC name is cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine.

Molecular Properties

Compound Namecyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine
PubChem CID162293732
Molecular FormulaC12H29N3
Molecular Weight215.38 g/mol
Exact Mass215.24
IUPAC Namecyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine
SMILESC1CCCC1.CNCC(N(C)C)N(C)C
InChIInChI=1S/C7H19N3.C5H10/c1-8-6-7(9(2)3)10(4)5;1-2-4-5-3-1/h7-8H,6H2,1-5H3;1-5H2
InChIKeyRTRJQWYTUDJGFM-UHFFFAOYSA-N
XLogP1.61
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.38
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-N,1-N,1-N',1-N'-tetramethyl-2-N-silylethane-1,1,2-triamine
CID 123544836
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CID 166769327
3-N-cycloheptyl-1-N,3-N,2-trimethylbutane-1,3-diamine
CID 79408924
(2R,3S)-3-(dimethylamino)-1-(methylamino)butan-2-ol
CID 54087327
(3R)-3-(dimethylamino)-1-(methylamino)butan-2-ol
CID 59946423
1-N,1-N,1-N',1-N',3-N,3-N,3-N',3-N'-octamethylpropane-1,1,3,3-tetramine
CID 87407012
(2R)-N-methyl-2-phosphanylpropan-1-amine
CID 171624131
2-cycloheptyl-N-methylpropan-1-amine
CID 82931674
N-methyl-2-[methyl(methylamino)amino]propan-1-amine
CID 147867609
1-N-cyclohexyl-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 43205547
2-N-cyclopropyl-1-N,2-N-dimethylpropane-1,2-diamine
CID 62419681
3-cyclohexyl-N,2-dimethylbutan-1-amine
CID 81015775

Frequently Asked Questions

What is the IUPAC name of cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine?
The IUPAC name of cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine (CID 162293732) is cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine.
What is the SMILES notation for cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine?
The canonical SMILES for cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine is C1CCCC1.CNCC(N(C)C)N(C)C.
What is the InChIKey of cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine?
The InChIKey is RTRJQWYTUDJGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3.C5H10/c1-8-6-7(9(2)3)10(4)5;1-2-4-5-3-1/h7-8H,6H2,1-5H3;1-5H2.
What are the key properties of cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine?
cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine has a molecular weight of 215.38 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;1-N,1-N,1-N',1-N',2-N-pentamethylethane-1,1,2-triamine is sourced from PubChem (CID 162293732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).