cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen

C11H28N2 — CID 169214779

IUPACcyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen
SMILESCNCC(C)C.NC1CCCCC1.[H][H]
InChIInChI=1S/C6H13N.C5H13N.H2/c7-6-4-2-1-3-5-6;1-5(2)4-6-3;/h6H,1-5,7H2;5-6H,4H2,1-3H3;1H
InChIKeyVHPQXCHLVBOSGB-UHFFFAOYSA-N
MW188.36 g/mol
LogP2.39
Rot. Bonds2

About cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen

cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen (PubChem CID 169214779) has the molecular formula C11H28N2 and a molecular weight of 188.36 g/mol. Its IUPAC name is cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen.

Molecular Properties

Compound Namecyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen
PubChem CID169214779
Molecular FormulaC11H28N2
Molecular Weight188.36 g/mol
Exact Mass188.23
IUPAC Namecyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen
SMILESCNCC(C)C.NC1CCCCC1.[H][H]
InChIInChI=1S/C6H13N.C5H13N.H2/c7-6-4-2-1-3-5-6;1-5(2)4-6-3;/h6H,1-5,7H2;5-6H,4H2,1-3H3;1H
InChIKeyVHPQXCHLVBOSGB-UHFFFAOYSA-N
XLogP2.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.36
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexanamine;2-methylpropan-1-amine
CID 22649730
N,2-dimethylpropan-1-amine;methanamine
CID 144585140
CID 175698442
CID 175698442
2-cycloheptyl-N-methylpropan-1-amine
CID 82931674
cyclohexanamine;N-methylbutan-1-amine
CID 22649907
azane;cyclohexanamine;ethanamine;N-ethylethanamine;N-methylethanamine
CID 157130667
3-cyclopentyl-N,2-dimethylpropan-1-amine
CID 62530877
cyclohexanamine;N-ethylethanamine;N-methylmethanamine;dihydrobromide
CID 160905019
3-cyclohexyl-N,2-dimethylbutan-1-amine
CID 81015775
azane;cycloheptanamine
CID 135353953
cyclohexanamine;ethanol
CID 159108869
cycloheptanamine;ethanol
CID 158239152

Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen?
The IUPAC name of cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen (CID 169214779) is cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen.
What is the SMILES notation for cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen?
The canonical SMILES for cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen is CNCC(C)C.NC1CCCCC1.[H][H].
What is the InChIKey of cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen?
The InChIKey is VHPQXCHLVBOSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C5H13N.H2/c7-6-4-2-1-3-5-6;1-5(2)4-6-3;/h6H,1-5,7H2;5-6H,4H2,1-3H3;1H.
What are the key properties of cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen?
cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen has a molecular weight of 188.36 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;N,2-dimethylpropan-1-amine;molecular hydrogen is sourced from PubChem (CID 169214779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).