1-propylcyclopropan-1-amine

C6H13N — CID 21437251

IUPAC1-propylcyclopropan-1-amine
SMILESCCCC1(N)CC1
InChIInChI=1S/C6H13N/c1-2-3-6(7)4-5-6/h2-5,7H2,1H3
InChIKeyZADCUMFVTUWSAW-UHFFFAOYSA-N
MW99.18 g/mol
LogP1.28
Rot. Bonds2

About 1-propylcyclopropan-1-amine

1-propylcyclopropan-1-amine (PubChem CID 21437251) has the molecular formula C6H13N and a molecular weight of 99.18 g/mol. Its IUPAC name is 1-propylcyclopropan-1-amine.

Molecular Properties

Compound Name1-propylcyclopropan-1-amine
PubChem CID21437251
Molecular FormulaC6H13N
Molecular Weight99.18 g/mol
Exact Mass99.10
IUPAC Name1-propylcyclopropan-1-amine
SMILESCCCC1(N)CC1
InChIInChI=1S/C6H13N/c1-2-3-6(7)4-5-6/h2-5,7H2,1H3
InChIKeyZADCUMFVTUWSAW-UHFFFAOYSA-N
XLogP1.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.18
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-propylcyclopropan-1-amine?
The IUPAC name of 1-propylcyclopropan-1-amine (CID 21437251) is 1-propylcyclopropan-1-amine.
What is the SMILES notation for 1-propylcyclopropan-1-amine?
The canonical SMILES for 1-propylcyclopropan-1-amine is CCCC1(N)CC1.
What is the InChIKey of 1-propylcyclopropan-1-amine?
The InChIKey is ZADCUMFVTUWSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N/c1-2-3-6(7)4-5-6/h2-5,7H2,1H3.
What are the key properties of 1-propylcyclopropan-1-amine?
1-propylcyclopropan-1-amine has a molecular weight of 99.18 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylcyclopropan-1-amine is sourced from PubChem (CID 21437251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).