N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide

C15H23N3O2 — CID 17185460

IUPACN-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCN(C(C)C)CC1
InChIInChI=1S/C15H23N3O2/c1-12(2)17-8-10-18(11-9-17)15(19)16-13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19)
InChIKeyGIGGPKHGZZKEBW-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.25
Rot. Bonds3

About N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide

N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide (PubChem CID 17185460) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
PubChem CID17185460
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCN(C(C)C)CC1
InChIInChI=1S/C15H23N3O2/c1-12(2)17-8-10-18(11-9-17)15(19)16-13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19)
InChIKeyGIGGPKHGZZKEBW-UHFFFAOYSA-N
XLogP2.25
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxy-5-methylphenyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 17185489
N-(2,5-dimethoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 17185486
N-(2-methoxyphenyl)-2-(4-propan-2-ylpiperazin-1-yl)acetamide
CID 34773711
4-(2-hydroxyethyl)-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 43393054
N-(2-methoxyphenyl)-4-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113112535
N-(2-methoxyphenyl)-4-[2-(2-methoxyphenyl)ethyl]piperazine-1-carboxamide
CID 113109273
4-cycloheptyl-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 113110513
1-[(2-methoxyphenyl)carbamoyl]-4-methylpiperidine-4-carboxylic acid
CID 63123407
N-[2-(2-methoxyphenyl)ethyl]-4-propan-2-ylpiperazine-1-carboxamide
CID 113103333
4-(2,5-dimethoxyphenyl)-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 113113504
N-(2-methoxyphenyl)-4-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 27869689
N-(4-chloro-3-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 122148707

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide (CID 17185460) is N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide is COc1ccccc1NC(=O)N1CCN(C(C)C)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide?
The InChIKey is GIGGPKHGZZKEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(2)17-8-10-18(11-9-17)15(19)16-13-6-4-5-7-14(13)20-3/h4-7,12H,8-11H2,1-3H3,(H,16,19).
What are the key properties of N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide?
N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 17185460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).