N-(2-piperidin-4-ylethyl)cyclopropanamine

C10H20N2 — CID 16640897

IUPACN-(2-piperidin-4-ylethyl)cyclopropanamine
SMILESC1CC(CCNC2CC2)CCN1
InChIInChI=1S/C10H20N2/c1-2-10(1)12-8-5-9-3-6-11-7-4-9/h9-12H,1-8H2
InChIKeyJENVVHWDSZXEAM-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.13
Rot. Bonds4

About N-(2-piperidin-4-ylethyl)cyclopropanamine

N-(2-piperidin-4-ylethyl)cyclopropanamine (PubChem CID 16640897) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-(2-piperidin-4-ylethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-piperidin-4-ylethyl)cyclopropanamine
PubChem CID16640897
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-(2-piperidin-4-ylethyl)cyclopropanamine
SMILESC1CC(CCNC2CC2)CCN1
InChIInChI=1S/C10H20N2/c1-2-10(1)12-8-5-9-3-6-11-7-4-9/h9-12H,1-8H2
InChIKeyJENVVHWDSZXEAM-UHFFFAOYSA-N
XLogP1.13
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-4-ylethyl)cyclopropanamine?
The IUPAC name of N-(2-piperidin-4-ylethyl)cyclopropanamine (CID 16640897) is N-(2-piperidin-4-ylethyl)cyclopropanamine.
What is the SMILES notation for N-(2-piperidin-4-ylethyl)cyclopropanamine?
The canonical SMILES for N-(2-piperidin-4-ylethyl)cyclopropanamine is C1CC(CCNC2CC2)CCN1.
What is the InChIKey of N-(2-piperidin-4-ylethyl)cyclopropanamine?
The InChIKey is JENVVHWDSZXEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-10(1)12-8-5-9-3-6-11-7-4-9/h9-12H,1-8H2.
What are the key properties of N-(2-piperidin-4-ylethyl)cyclopropanamine?
N-(2-piperidin-4-ylethyl)cyclopropanamine has a molecular weight of 168.28 g/mol, XLogP of 1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-ylethyl)cyclopropanamine is sourced from PubChem (CID 16640897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).