2-cyclopropyl-1,1-dipropylguanidine

C10H21N3 — CID 62359563

IUPAC2-cyclopropyl-1,1-dipropylguanidine
SMILESCCCN(CCC)/C(N)=N/C1CC1
InChIInChI=1S/C10H21N3/c1-3-7-13(8-4-2)10(11)12-9-5-6-9/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyBWNMHGOOLOGMHH-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.59
Rot. Bonds5

About 2-cyclopropyl-1,1-dipropylguanidine

2-cyclopropyl-1,1-dipropylguanidine (PubChem CID 62359563) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 2-cyclopropyl-1,1-dipropylguanidine.

Molecular Properties

Compound Name2-cyclopropyl-1,1-dipropylguanidine
PubChem CID62359563
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name2-cyclopropyl-1,1-dipropylguanidine
SMILESCCCN(CCC)/C(N)=N/C1CC1
InChIInChI=1S/C10H21N3/c1-3-7-13(8-4-2)10(11)12-9-5-6-9/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyBWNMHGOOLOGMHH-UHFFFAOYSA-N
XLogP1.59
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,1-dipropylguanidine?
The IUPAC name of 2-cyclopropyl-1,1-dipropylguanidine (CID 62359563) is 2-cyclopropyl-1,1-dipropylguanidine.
What is the SMILES notation for 2-cyclopropyl-1,1-dipropylguanidine?
The canonical SMILES for 2-cyclopropyl-1,1-dipropylguanidine is CCCN(CCC)/C(N)=N/C1CC1.
What is the InChIKey of 2-cyclopropyl-1,1-dipropylguanidine?
The InChIKey is BWNMHGOOLOGMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-7-13(8-4-2)10(11)12-9-5-6-9/h9H,3-8H2,1-2H3,(H2,11,12).
What are the key properties of 2-cyclopropyl-1,1-dipropylguanidine?
2-cyclopropyl-1,1-dipropylguanidine has a molecular weight of 183.30 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1,1-dipropylguanidine is sourced from PubChem (CID 62359563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).