1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine

C17H24N4 — CID 63374122

IUPAC1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine
SMILESCCN1CCN(c2cc(CNC)nc3ccccc23)CC1
InChIInChI=1S/C17H24N4/c1-3-20-8-10-21(11-9-20)17-12-14(13-18-2)19-16-7-5-4-6-15(16)17/h4-7,12,18H,3,8-11,13H2,1-2H3
InChIKeyMOZJGWQEDUGZMT-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.10
Rot. Bonds4

About 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine

1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine (PubChem CID 63374122) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine
PubChem CID63374122
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine
SMILESCCN1CCN(c2cc(CNC)nc3ccccc23)CC1
InChIInChI=1S/C17H24N4/c1-3-20-8-10-21(11-9-20)17-12-14(13-18-2)19-16-7-5-4-6-15(16)17/h4-7,12,18H,3,8-11,13H2,1-2H3
InChIKeyMOZJGWQEDUGZMT-UHFFFAOYSA-N
XLogP2.10
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine (CID 63374122) is 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine is CCN1CCN(c2cc(CNC)nc3ccccc23)CC1.
What is the InChIKey of 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine?
The InChIKey is MOZJGWQEDUGZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-3-20-8-10-21(11-9-20)17-12-14(13-18-2)19-16-7-5-4-6-15(16)17/h4-7,12,18H,3,8-11,13H2,1-2H3.
What are the key properties of 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine?
1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine has a molecular weight of 284.41 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-ethylpiperazin-1-yl)quinolin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 63374122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).