cyclopropane;N'-propylethane-1,2-diamine

C8H20N2 — CID 175530712

IUPACcyclopropane;N'-propylethane-1,2-diamine
SMILESC1CC1.CCCNCCN
InChIInChI=1S/C5H14N2.C3H6/c1-2-4-7-5-3-6;1-2-3-1/h7H,2-6H2,1H3;1-3H2
InChIKeyPXWVEBNLULTCND-UHFFFAOYSA-N
MW144.26 g/mol
LogP1.12
Rot. Bonds4

About cyclopropane;N'-propylethane-1,2-diamine

cyclopropane;N'-propylethane-1,2-diamine (PubChem CID 175530712) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is cyclopropane;N'-propylethane-1,2-diamine.

Molecular Properties

Compound Namecyclopropane;N'-propylethane-1,2-diamine
PubChem CID175530712
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Namecyclopropane;N'-propylethane-1,2-diamine
SMILESC1CC1.CCCNCCN
InChIInChI=1S/C5H14N2.C3H6/c1-2-4-7-5-3-6;1-2-3-1/h7H,2-6H2,1H3;1-3H2
InChIKeyPXWVEBNLULTCND-UHFFFAOYSA-N
XLogP1.12
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

azane;N'-propylethane-1,2-diamine
CID 87476258
formaldehyde;N'-[2-(propylamino)ethyl]ethane-1,2-diamine
CID 174938120
N'-docosylethane-1,2-diamine
CID 18783196
N'-henicosylethane-1,2-diamine
CID 22930907
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
cyclohexane;propan-1-amine
CID 159085812
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;hexan-1-amine
CID 87602895
N'-[2-(hexatriacontylamino)ethyl]ethane-1,2-diamine
CID 88704371
N-[2-(propylamino)ethyl]-N'-[2-[2-[2-[3-[2-(propylamino)ethylamino]propylamino]ethylamino]ethylamino]ethyl]propane-1,3-diamine
CID 21145819
N',N'-bis(2-aminoethyl)-N-propylpropane-1,3-diamine
CID 20586475
azane;N-propylpropan-1-amine;trihydrochloride
CID 173212322

Frequently Asked Questions

What is the IUPAC name of cyclopropane;N'-propylethane-1,2-diamine?
The IUPAC name of cyclopropane;N'-propylethane-1,2-diamine (CID 175530712) is cyclopropane;N'-propylethane-1,2-diamine.
What is the SMILES notation for cyclopropane;N'-propylethane-1,2-diamine?
The canonical SMILES for cyclopropane;N'-propylethane-1,2-diamine is C1CC1.CCCNCCN.
What is the InChIKey of cyclopropane;N'-propylethane-1,2-diamine?
The InChIKey is PXWVEBNLULTCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2.C3H6/c1-2-4-7-5-3-6;1-2-3-1/h7H,2-6H2,1H3;1-3H2.
What are the key properties of cyclopropane;N'-propylethane-1,2-diamine?
cyclopropane;N'-propylethane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;N'-propylethane-1,2-diamine is sourced from PubChem (CID 175530712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).