4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide

C22H30N4O4 — CID 142633781

IUPAC4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide
SMILESCCCc1cnc(OC)c(NC(=O)N2CCN(c3cc(OC)cc(OC)c3)CC2)c1
InChIInChI=1S/C22H30N4O4/c1-5-6-16-11-20(21(30-4)23-15-16)24-22(27)26-9-7-25(8-10-26)17-12-18(28-2)14-19(13-17)29-3/h11-15H,5-10H2,1-4H3,(H,24,27)
InChIKeyYYLNZADMWYSCRJ-UHFFFAOYSA-N
MW414.51 g/mol
LogP3.41
Rot. Bonds7

About 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide

4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide (PubChem CID 142633781) has the molecular formula C22H30N4O4 and a molecular weight of 414.51 g/mol. Its IUPAC name is 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide
PubChem CID142633781
Molecular FormulaC22H30N4O4
Molecular Weight414.51 g/mol
Exact Mass414.23
IUPAC Name4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide
SMILESCCCc1cnc(OC)c(NC(=O)N2CCN(c3cc(OC)cc(OC)c3)CC2)c1
InChIInChI=1S/C22H30N4O4/c1-5-6-16-11-20(21(30-4)23-15-16)24-22(27)26-9-7-25(8-10-26)17-12-18(28-2)14-19(13-17)29-3/h11-15H,5-10H2,1-4H3,(H,24,27)
InChIKeyYYLNZADMWYSCRJ-UHFFFAOYSA-N
XLogP3.41
TPSA76.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(3,5-dimethoxyphenyl)-N-(5-ethyl-6-methyl-2-phenoxy-3-pyridinyl)piperazine-1-carboxamide
CID 18663143
4-(3,5-difluorophenyl)-N-(2-methoxy-6-methyl-5-propyl-3-pyridinyl)piperazine-1-carboxamide
CID 19357182
N-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)-4-(4-methylphenyl)piperazine-1-carboxamide
CID 18663113
N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide
CID 113113542
4-(3,5-dimethoxyphenyl)-N-(3,7-dimethoxyquinoxalin-2-yl)piperazine-1-carboxamide
CID 69243350
N-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)-4-(3,4,5-trimethoxyphenyl)piperazine-1-carboxamide
CID 18663089
4-(3,5-dimethoxyphenyl)-N-(5-ethyl-6-methyl-2-piperazin-1-yl-3-pyridinyl)piperazine-1-carboxamide
CID 57027576
4-(3,5-dimethoxyphenyl)-N-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)piperazine-1-carbothioamide
CID 54396849
4-(3,5-dimethoxyphenyl)-N-(3-methoxy-6-methylquinoxalin-2-yl)piperazine-1-carboxamide
CID 69244400
N-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)-4-(3-hydroxy-4-methoxyphenyl)piperazine-1-carboxamide
CID 18663099
4-(3-chlorophenyl)-N-(2-methoxy-3-pyridinyl)piperazine-1-carboxamide
CID 18663039
4-(3-chloro-4-methoxyphenyl)-N-(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)piperazine-1-carboxamide
CID 18663096

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide?
The IUPAC name of 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide (CID 142633781) is 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide is CCCc1cnc(OC)c(NC(=O)N2CCN(c3cc(OC)cc(OC)c3)CC2)c1.
What is the InChIKey of 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide?
The InChIKey is YYLNZADMWYSCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O4/c1-5-6-16-11-20(21(30-4)23-15-16)24-22(27)26-9-7-25(8-10-26)17-12-18(28-2)14-19(13-17)29-3/h11-15H,5-10H2,1-4H3,(H,24,27).
What are the key properties of 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide?
4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide has a molecular weight of 414.51 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxyphenyl)-N-(2-methoxy-5-propyl-3-pyridinyl)piperazine-1-carboxamide is sourced from PubChem (CID 142633781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).