1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine

C9H17N — CID 162011591

IUPAC1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine
SMILESCCCC1(N)C2CCC21C
InChIInChI=1S/C9H17N/c1-3-5-9(10)7-4-6-8(7,9)2/h7H,3-6,10H2,1-2H3
InChIKeyYTNZLFCHCVHXHE-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.91
Rot. Bonds2

About 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine

1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine (PubChem CID 162011591) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine.

Molecular Properties

Compound Name1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine
PubChem CID162011591
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine
SMILESCCCC1(N)C2CCC21C
InChIInChI=1S/C9H17N/c1-3-5-9(10)7-4-6-8(7,9)2/h7H,3-6,10H2,1-2H3
InChIKeyYTNZLFCHCVHXHE-UHFFFAOYSA-N
XLogP1.91
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine?
The IUPAC name of 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine (CID 162011591) is 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine.
What is the SMILES notation for 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine?
The canonical SMILES for 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine is CCCC1(N)C2CCC21C.
What is the InChIKey of 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine?
The InChIKey is YTNZLFCHCVHXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-3-5-9(10)7-4-6-8(7,9)2/h7H,3-6,10H2,1-2H3.
What are the key properties of 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine?
1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine has a molecular weight of 139.24 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-propylbicyclo[2.1.0]pentan-5-amine is sourced from PubChem (CID 162011591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).