4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide

C19H25N5O3 — CID 136541606

IUPAC4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide
SMILESCOc1cccc(N2CCN(C(=O)Nc3ccc(OC(C)C)nn3)CC2)c1
InChIInChI=1S/C19H25N5O3/c1-14(2)27-18-8-7-17(21-22-18)20-19(25)24-11-9-23(10-12-24)15-5-4-6-16(13-15)26-3/h4-8,13-14H,9-12H2,1-3H3,(H,20,21,25)
InChIKeyQOMPYQIXOXBJBE-UHFFFAOYSA-N
MW371.44 g/mol
LogP2.63
Rot. Bonds5

About 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide

4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide (PubChem CID 136541606) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide
PubChem CID136541606
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide
SMILESCOc1cccc(N2CCN(C(=O)Nc3ccc(OC(C)C)nn3)CC2)c1
InChIInChI=1S/C19H25N5O3/c1-14(2)27-18-8-7-17(21-22-18)20-19(25)24-11-9-23(10-12-24)15-5-4-6-16(13-15)26-3/h4-8,13-14H,9-12H2,1-3H3,(H,20,21,25)
InChIKeyQOMPYQIXOXBJBE-UHFFFAOYSA-N
XLogP2.63
TPSA79.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methoxyphenyl)-4-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 113113577
4-(3-methoxyphenyl)-N-(3-methylphenyl)piperazine-1-carboxamide
CID 16645833
N-(3-methoxyphenyl)-4-phenylpiperazine-1-carboxamide
CID 6469276
4-(3-methoxyphenyl)-N-(3-methylbutyl)piperazine-1-carboxamide
CID 86912572
1-[4-(3-methoxyphenyl)piperazin-1-yl]-3-methylbutan-1-one
CID 78768997
N-[(1S)-1-(furan-2-yl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carboxamide
CID 94017976
4-(3-methoxyphenyl)-N-(3,6,7-trimethoxyquinoxalin-2-yl)piperazine-1-carboxamide
CID 69244515
4-(3-hydroxyphenyl)-N-(6-methoxypyrimidin-4-yl)piperazine-1-carboxamide
CID 138043019
4-(3-cyanophenyl)-N-(3-methoxyphenyl)piperazine-1-carboxamide
CID 113113611
N-(2-ethoxyphenyl)-4-(3-methoxyphenyl)piperazine-1-carboxamide
CID 113113542
N-(3-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 2982408
N-[4-[4-(3-methoxyphenyl)piperazine-1-carbonyl]phenyl]acetamide
CID 9372260

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide?
The IUPAC name of 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide (CID 136541606) is 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide is COc1cccc(N2CCN(C(=O)Nc3ccc(OC(C)C)nn3)CC2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide?
The InChIKey is QOMPYQIXOXBJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-14(2)27-18-8-7-17(21-22-18)20-19(25)24-11-9-23(10-12-24)15-5-4-6-16(13-15)26-3/h4-8,13-14H,9-12H2,1-3H3,(H,20,21,25).
What are the key properties of 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide?
4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-N-(6-propan-2-yloxypyridazin-3-yl)piperazine-1-carboxamide is sourced from PubChem (CID 136541606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).