azane;2-methylpentane

C6H17N — CID 18347292

IUPACazane;2-methylpentane
SMILESCCCC(C)C.N
InChIInChI=1S/C6H14.H3N/c1-4-5-6(2)3;/h6H,4-5H2,1-3H3;1H3
InChIKeyRNFKFKWFQVKJBU-UHFFFAOYSA-N
MW103.21 g/mol
LogP2.60
Rot. Bonds2

About azane;2-methylpentane

azane;2-methylpentane (PubChem CID 18347292) has the molecular formula C6H17N and a molecular weight of 103.21 g/mol. Its IUPAC name is azane;2-methylpentane.

Molecular Properties

Compound Nameazane;2-methylpentane
PubChem CID18347292
Molecular FormulaC6H17N
Molecular Weight103.21 g/mol
Exact Mass103.14
IUPAC Nameazane;2-methylpentane
SMILESCCCC(C)C.N
InChIInChI=1S/C6H14.H3N/c1-4-5-6(2)3;/h6H,4-5H2,1-3H3;1H3
InChIKeyRNFKFKWFQVKJBU-UHFFFAOYSA-N
XLogP2.60
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.21
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

azane;2-methylpentane
CID 87098569
2-methylpentane
CID 7892
ethane;2-methylpentane
CID 143713716
2-methylpentane;hydroiodide
CID 160726714
2-methylpentane;titanium(4+);tetrachloride
CID 158147790
ethane;methane;bis(2-methylpentane)
CID 142143156
methane;2-methylpentane;propane
CID 161026516
hexane;2-methylpentane
CID 19835603
ethanamine;2-methylpentane
CID 143240474
ethane;2-methylpentane;pentane;propane
CID 142044971
2-methylpentane diisocyanate
CID 22323257
ethane;2-methylpentane;prop-1-yne
CID 143374502

Frequently Asked Questions

What is the IUPAC name of azane;2-methylpentane?
The IUPAC name of azane;2-methylpentane (CID 18347292) is azane;2-methylpentane.
What is the SMILES notation for azane;2-methylpentane?
The canonical SMILES for azane;2-methylpentane is CCCC(C)C.N.
What is the InChIKey of azane;2-methylpentane?
The InChIKey is RNFKFKWFQVKJBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14.H3N/c1-4-5-6(2)3;/h6H,4-5H2,1-3H3;1H3.
What are the key properties of azane;2-methylpentane?
azane;2-methylpentane has a molecular weight of 103.21 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-methylpentane is sourced from PubChem (CID 18347292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).