2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine

C15H24N4O — CID 114937069

IUPAC2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine
SMILESCOc1ccc(C(CN)N2CCN(C3CC3)CC2)cn1
InChIInChI=1S/C15H24N4O/c1-20-15-5-2-12(11-17-15)14(10-16)19-8-6-18(7-9-19)13-3-4-13/h2,5,11,13-14H,3-4,6-10,16H2,1H3
InChIKeyOCZMSXNMJDQPCB-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.87
Rot. Bonds5

About 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine

2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine (PubChem CID 114937069) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine
PubChem CID114937069
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine
SMILESCOc1ccc(C(CN)N2CCN(C3CC3)CC2)cn1
InChIInChI=1S/C15H24N4O/c1-20-15-5-2-12(11-17-15)14(10-16)19-8-6-18(7-9-19)13-3-4-13/h2,5,11,13-14H,3-4,6-10,16H2,1H3
InChIKeyOCZMSXNMJDQPCB-UHFFFAOYSA-N
XLogP0.87
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine?
The IUPAC name of 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine (CID 114937069) is 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine is COc1ccc(C(CN)N2CCN(C3CC3)CC2)cn1.
What is the InChIKey of 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine?
The InChIKey is OCZMSXNMJDQPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-20-15-5-2-12(11-17-15)14(10-16)19-8-6-18(7-9-19)13-3-4-13/h2,5,11,13-14H,3-4,6-10,16H2,1H3.
What are the key properties of 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine?
2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine has a molecular weight of 276.38 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylpiperazin-1-yl)-2-(6-methoxy-3-pyridinyl)ethanamine is sourced from PubChem (CID 114937069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).