1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride

C7H15ClN2 — CID 135392119

IUPAC1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride
SMILESCl.NC1(C2CCNC2)CC1
InChIInChI=1S/C7H14N2.ClH/c8-7(2-3-7)6-1-4-9-5-6;/h6,9H,1-5,8H2;1H
InChIKeyVCYCVIBLLBXFKJ-UHFFFAOYSA-N
MW162.66 g/mol
LogP0.51
Rot. Bonds1

About 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride

1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride (PubChem CID 135392119) has the molecular formula C7H15ClN2 and a molecular weight of 162.66 g/mol. Its IUPAC name is 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride
PubChem CID135392119
Molecular FormulaC7H15ClN2
Molecular Weight162.66 g/mol
Exact Mass162.09
IUPAC Name1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride
SMILESCl.NC1(C2CCNC2)CC1
InChIInChI=1S/C7H14N2.ClH/c8-7(2-3-7)6-1-4-9-5-6;/h6,9H,1-5,8H2;1H
InChIKeyVCYCVIBLLBXFKJ-UHFFFAOYSA-N
XLogP0.51
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.66
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride?
The IUPAC name of 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride (CID 135392119) is 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride.
What is the SMILES notation for 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride?
The canonical SMILES for 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride is Cl.NC1(C2CCNC2)CC1.
What is the InChIKey of 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride?
The InChIKey is VCYCVIBLLBXFKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.ClH/c8-7(2-3-7)6-1-4-9-5-6;/h6,9H,1-5,8H2;1H.
What are the key properties of 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride?
1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride has a molecular weight of 162.66 g/mol, XLogP of 0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-3-ylcyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 135392119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).