[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone

C19H24N4O2 — CID 57050933

IUPAC[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone
SMILESCCNc1cccnc1N1CCN(C(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C19H24N4O2/c1-3-20-17-5-4-10-21-18(17)22-11-13-23(14-12-22)19(24)15-6-8-16(25-2)9-7-15/h4-10,20H,3,11-14H2,1-2H3
InChIKeyXFTLSVFEXIBNRK-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.48
Rot. Bonds5

About [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone

[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone (PubChem CID 57050933) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone
PubChem CID57050933
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone
SMILESCCNc1cccnc1N1CCN(C(=O)c2ccc(OC)cc2)CC1
InChIInChI=1S/C19H24N4O2/c1-3-20-17-5-4-10-21-18(17)22-11-13-23(14-12-22)19(24)15-6-8-16(25-2)9-7-15/h4-10,20H,3,11-14H2,1-2H3
InChIKeyXFTLSVFEXIBNRK-UHFFFAOYSA-N
XLogP2.48
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]pyridin-3-amine
CID 15953887
(4-methoxyphenyl)-(4-quinolin-8-ylpiperazin-1-yl)methanone
CID 113079735
N-[2-(dimethylamino)ethyl]-6-[4-[3-(ethylamino)-2-pyridinyl]piperazine-1-carbonyl]pyridine-3-carboxamide
CID 18362862
(4-methoxyphenyl)-[4-(5-propylpyrimidin-2-yl)piperazin-1-yl]methanone
CID 2811138
[4-(4-methoxybenzoyl)piperazin-1-yl]-phenylmethanone
CID 3150576
[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(5-phenylmethoxy-1H-indol-3-yl)methanone
CID 57065668
(4-methoxyphenyl)-[4-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]-1,4-diazepan-1-yl]methanone
CID 53182130
6-[4-[3-(ethylamino)-2-pyridinyl]piperazine-1-carbonyl]-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 18362852
[4-(4-methoxyphenyl)piperazin-1-yl]-pyridin-4-ylmethanone
CID 1244092
[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(5-fluoro-1H-indol-3-yl)methanone
CID 57234124
10-[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]decan-1-ol
CID 19894566
4-benzyl-2-[4-(4-ethoxybenzoyl)piperazin-1-yl]pyrido[2,3-b]pyrazin-3-one
CID 53021537

Frequently Asked Questions

What is the IUPAC name of [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone?
The IUPAC name of [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone (CID 57050933) is [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone.
What is the SMILES notation for [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone?
The canonical SMILES for [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone is CCNc1cccnc1N1CCN(C(=O)c2ccc(OC)cc2)CC1.
What is the InChIKey of [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone?
The InChIKey is XFTLSVFEXIBNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-20-17-5-4-10-21-18(17)22-11-13-23(14-12-22)19(24)15-6-8-16(25-2)9-7-15/h4-10,20H,3,11-14H2,1-2H3.
What are the key properties of [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone?
[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone has a molecular weight of 340.43 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(4-methoxyphenyl)methanone is sourced from PubChem (CID 57050933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).