1-(1-propan-2-ylpiperidin-3-yl)ethenamine

C10H20N2 — CID 58547319

IUPAC1-(1-propan-2-ylpiperidin-3-yl)ethenamine
SMILESC=C(N)C1CCCN(C(C)C)C1
InChIInChI=1S/C10H20N2/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8,10H,3-7,11H2,1-2H3
InChIKeyHZTFGSIJQSKDEV-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.58
Rot. Bonds2

About 1-(1-propan-2-ylpiperidin-3-yl)ethenamine

1-(1-propan-2-ylpiperidin-3-yl)ethenamine (PubChem CID 58547319) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-(1-propan-2-ylpiperidin-3-yl)ethenamine.

Molecular Properties

Compound Name1-(1-propan-2-ylpiperidin-3-yl)ethenamine
PubChem CID58547319
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-(1-propan-2-ylpiperidin-3-yl)ethenamine
SMILESC=C(N)C1CCCN(C(C)C)C1
InChIInChI=1S/C10H20N2/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8,10H,3-7,11H2,1-2H3
InChIKeyHZTFGSIJQSKDEV-UHFFFAOYSA-N
XLogP1.58
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-propan-2-ylpiperidin-3-yl)ethenamine?
The IUPAC name of 1-(1-propan-2-ylpiperidin-3-yl)ethenamine (CID 58547319) is 1-(1-propan-2-ylpiperidin-3-yl)ethenamine.
What is the SMILES notation for 1-(1-propan-2-ylpiperidin-3-yl)ethenamine?
The canonical SMILES for 1-(1-propan-2-ylpiperidin-3-yl)ethenamine is C=C(N)C1CCCN(C(C)C)C1.
What is the InChIKey of 1-(1-propan-2-ylpiperidin-3-yl)ethenamine?
The InChIKey is HZTFGSIJQSKDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-8(2)12-6-4-5-10(7-12)9(3)11/h8,10H,3-7,11H2,1-2H3.
What are the key properties of 1-(1-propan-2-ylpiperidin-3-yl)ethenamine?
1-(1-propan-2-ylpiperidin-3-yl)ethenamine has a molecular weight of 168.28 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propan-2-ylpiperidin-3-yl)ethenamine is sourced from PubChem (CID 58547319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).