ethanamine;pentane

C7H19N — CID 87764211

IUPACethanamine;pentane
SMILESCCCCC.CCN
InChIInChI=1S/C5H12.C2H7N/c1-3-5-4-2;1-2-3/h3-5H2,1-2H3;2-3H2,1H3
InChIKeySGXFXFPXDNIUKB-UHFFFAOYSA-N
MW117.24 g/mol
LogP2.16
Rot. Bonds2

About ethanamine;pentane

ethanamine;pentane (PubChem CID 87764211) has the molecular formula C7H19N and a molecular weight of 117.24 g/mol. Its IUPAC name is ethanamine;pentane.

Molecular Properties

Compound Nameethanamine;pentane
PubChem CID87764211
Molecular FormulaC7H19N
Molecular Weight117.24 g/mol
Exact Mass117.15
IUPAC Nameethanamine;pentane
SMILESCCCCC.CCN
InChIInChI=1S/C5H12.C2H7N/c1-3-5-4-2;1-2-3/h3-5H2,1-2H3;2-3H2,1H3
InChIKeySGXFXFPXDNIUKB-UHFFFAOYSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze ethanamine;pentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

hexadecakis(pentane);dihydrate
CID 173099119
alumane;pentane
CID 173125985
CID 159411255
CID 159411255
pentane;propane
CID 91422342
zinc pentane
CID 19065630
pentane;rhodium
CID 173105348
CID 157215984
CID 157215984
pentane;stannane
CID 173279416
ethane;pentane;thiohydroxylamine
CID 144897257
methane;pentane;propane
CID 159978864
calcium;pentane;dichloride
CID 174907743
ethene;pentane
CID 54525676

Frequently Asked Questions

What is the IUPAC name of ethanamine;pentane?
The IUPAC name of ethanamine;pentane (CID 87764211) is ethanamine;pentane.
What is the SMILES notation for ethanamine;pentane?
The canonical SMILES for ethanamine;pentane is CCCCC.CCN.
What is the InChIKey of ethanamine;pentane?
The InChIKey is SGXFXFPXDNIUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12.C2H7N/c1-3-5-4-2;1-2-3/h3-5H2,1-2H3;2-3H2,1H3.
What are the key properties of ethanamine;pentane?
ethanamine;pentane has a molecular weight of 117.24 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;pentane is sourced from PubChem (CID 87764211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).